1-methyl-3-[(1S,2R)-3-(methylamino)-2-oxidanyl-1-phenyl-propyl]benzimidazol-2-one hydrochloride

Systemtic Name: 1-methyl-3-[(1S,2R)-3-(methylamino)-2-oxidanyl-1-phenyl-propyl]benzimidazol-2-one hydrochloride Openeye Name: 1-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenyl-propyl]-3-methyl-benzimidazol-2-one hydrochloride CAS Name: 1-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenylpropyl]-3-methyl-2-benzimidazolone hydrochloride IUPAC Name: 1-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenylpropyl]-3-methylbenzimidazol-2-one hydrochloride Traditional Name: 1-[(1S,2R)-2-hydroxy-3-(methylamino)-1-phenyl-propyl]-3-methyl-benzimidazol-2-one hydrochloride Formula: C18H22ClN3O2 MolecularWeight: 347.83918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCC(C(C1=CC=CC=C1)N2C3=CC=CC=C3N(C2=O)C)O.Cl

Isomeric SMILES

CNC[C@H]([C@H](C1=CC=CC=C1)N2C3=CC=CC=C3N(C2=O)C)O.Cl

InChI

InChI=1S/C18H21N3O2.ClH/c1-19-12-16(22)17(13-8-4-3-5-9-13)21-15-11-7-6-10-14(15)20(2)18(21)23;/h3-11,16-17,19,22H,12H2,1-2H3;1H/t16-,17+;/m1./s1