Molecule ID: 68592

IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethanol;hydrochloride

Description: The molecule is a hydrochloride salt resulting from the mixture of equimolar amounts of metronidazole and hydrogen chloride. It has a role as an antibacterial drug, an antimicrobial agent, an antiparasitic agent, an antitrichomonal drug and a prodrug. It contains a metronidazole(1+).

SMILES: Cc1ncc([N+](=O)[O-])n1CCO.Cl

SELFIES: [C][C][=N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][N][Ring1][Branch2][C][C][O].[Cl]

InChI: InChI=1S/C6H9N3O3.ClH/c1-5-7-4-6(9(11)12)8(5)2-3-10;/h4,10H,2-3H2,1H3;1H

Molecular Properties:
- Polar Surface Area: 83.9 Ų
- LogP: nan