Perindopril
C19H32N2O5
82834-16-0 Copyright (C) 2024 ACS
 28 29  0  0  1  0  0  0  0  0999 V2000
    5.3167    6.6685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0867    5.3347    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0867    8.0021    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6267    5.3347    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3167    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3967    4.0011    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.9367    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6267    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7067    5.3347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7067    2.6674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3967    1.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2467    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6267    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0167    6.6685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3473    9.3789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3169   10.5234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8538    9.6991    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7767    6.6685    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8715    5.4225    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8715    7.9144    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4069    5.8985    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1917    3.9162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4069    7.4385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2624    4.8679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0473    2.8858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5826    3.3617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3779    5.1023    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.5248    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1 18  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  1  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  6  0  0  0
  7  9  1  0  0  0  0
  7 10  2  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 20 15  1  1  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 19 27  1  6  0  0  0
 20 23  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
 21 28  1  6  0  0  0
 22 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
> <cas.rn>
82834-16-0

> <cas.index.name>
1H-Indole-2-carboxylic acid, 1-[(2S)-2-[[(1S)-1-(ethoxycarbonyl)butyl]amino]-1-oxopropyl]octahydro-, (2S,3aS,7aS)-

> <molecular.formula>
C19H32N2O5

> <molecular.weight>
368.47

> <boiling.point.predicted>
537.371±45.00 °C    Press: 760.00 Torr

> <density.predicted>
1.150±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
3.151±0.20    Most Acidic Temp: 25 °C

$$$$
