3-(1H-imidazol-5-ylmethyl)-N-methyl-2-oxidanyl-benzamide hydrochloride

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-N-methyl-2-oxidanyl-benzamide hydrochloride Openeye Name: 2-hydroxy-3-(1H-imidazol-5-ylmethyl)-N-methyl-benzamide hydrochloride CAS Name: 2-hydroxy-3-(1H-imidazol-5-ylmethyl)-N-methylbenzamide hydrochloride IUPAC Name: 2-hydroxy-3-(1H-imidazol-5-ylmethyl)-N-methylbenzamide hydrochloride Traditional Name: 2-hydroxy-3-(1H-imidazol-5-ylmethyl)-N-methyl-benzamide hydrochloride Formula: C12H14ClN3O2 MolecularWeight: 267.71146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(C(=CC=C1)CC2=CN=CN2)O.Cl

Isomeric SMILES

CNC(=O)C1=C(C(=CC=C1)CC2=CN=CN2)O.Cl

InChI

InChI=1S/C12H13N3O2.ClH/c1-13-12(17)10-4-2-3-8(11(10)16)5-9-6-14-7-15-9;/h2-4,6-7,16H,5H2,1H3,(H,13,17)(H,14,15);1H