Cilazapril monohydrate

CAS Registry Number®

92077-78-6

CAS Name

Cilazapril monohydrate

Molecular Formula

C22H31N3O5.H2O

Cite this Page

Cilazapril monohydrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=92077-78-6 (retrieved 2024-11-21) (CAS RN: 92077-78-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H31N3O5.H2O/c1-2-30-22(29)18(13-12-16-8-4-3-5-9-16)23-17-10-6-14-24-15-7-11-19(21(27)28)25(24)20(17)26;/h3-5,8-9,17-19,23H,2,6-7,10-15H2,1H3,(H,27,28);1H2/t17-,18-,19-;/m0./s1

InChIKey

InChIKey=JQRZBPFGBRIWSN-YOTVLOEGSA-N

SMILES

C(O)(=O)[C@H]1N2N(CCC1)CCC[C@H](N[C@@H](CCC3=CC=CC=C3)C(OCC)=O)C2=O.O

Canonical SMILES

O=C(O)C1N2C(=O)C(NC(C(=O)OCC)CCC=3C=CC=CC3)CCCN2CCC1.O

Other Names for this Substance

  • 6H-Pyridazino[1,2-a][1,2]diazepine-1-carboxylic acid, 9-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]octahydro-10-oxo-, hydrate (1:1), (1S,9S)-
  • 6H-Pyridazino[1,2-a][1,2]diazepine-1-carboxylic acid, 9-[[1-(ethoxycarbonyl)-3-phenylpropyl]amino]octahydro-10-oxo-, monohydrate, [1S-[1α,9α(R*)]]-
  • 6H-Pyridazino[1,2-a][1,2]diazepine-1-carboxylic acid, 9-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]octahydro-10-oxo-, monohydrate, (1S,9S)-
  • Cilazapril monohydrate

CAS INSIGHTSTM
Targeted protein degrader structure, illustration