Molecule ID: 43834305

IUPAC Name: [1-(2-chlorophenyl)-2-oxocyclohexyl]-methylazanium;chloride

Description: The molecule is the hydrochloride salt of ketamine. It has a role as an analgesic, a NMDA receptor antagonist and an intravenous anaesthetic. It contains a ketamine.

SMILES: CNC1(c2ccccc2Cl)CCCCC1=O.Cl

SELFIES: [C][N][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][C][C][C][C][Ring1][=N][=O].[Cl]

InChI: InChI=1S/C13H16ClNO.ClH/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14;/h2-3,6-7,15H,4-5,8-9H2,1H3;1H

Molecular Properties:
- Polar Surface Area: 33.7 Ų
- LogP: nan