5-[2-azanyl-2-(3-methylphenyl)-1-oxidanyl-ethyl]-1-cyclopentyl-3-methyl-benzimidazol-2-one hydrochloride

Systemtic Name: 5-[2-azanyl-2-(3-methylphenyl)-1-oxidanyl-ethyl]-1-cyclopentyl-3-methyl-benzimidazol-2-one hydrochloride Openeye Name: 5-[2-amino-1-hydroxy-2-(m-tolyl)ethyl]-1-cyclopentyl-3-methyl-benzimidazol-2-one hydrochloride CAS Name: 5-[2-amino-1-hydroxy-2-(3-methylphenyl)ethyl]-1-cyclopentyl-3-methyl-2-benzimidazolone hydrochloride IUPAC Name: 5-[2-amino-1-hydroxy-2-(3-methylphenyl)ethyl]-1-cyclopentyl-3-methylbenzimidazol-2-one hydrochloride Traditional Name: 5-[2-amino-1-hydroxy-2-(m-tolyl)ethyl]-1-cyclopentyl-3-methyl-benzimidazol-2-one hydrochloride Formula: C22H28ClN3O2 MolecularWeight: 401.92962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C(C2=CC3=C(C=C2)N(C(=O)N3C)C4CCCC4)O)N.Cl

Isomeric SMILES

CC1=CC(=CC=C1)C(C(C2=CC3=C(C=C2)N(C(=O)N3C)C4CCCC4)O)N.Cl

InChI

InChI=1S/C22H27N3O2.ClH/c1-14-6-5-7-15(12-14)20(23)21(26)16-10-11-18-19(13-16)24(2)22(27)25(18)17-8-3-4-9-17;/h5-7,10-13,17,20-21,26H,3-4,8-9,23H2,1-2H3;1H