1-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]-1-piperidyl]-2-phenyl-butan-1-one CAS Name: 1-[4-[(5,6-dimethyl-1-benzimidazolyl)methyl]-1-piperidinyl]-2-phenyl-1-butanone IUPAC Name: 1-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidino]-2-phenyl-butan-1-one Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCC(CC2)CN3C=NC4=C3C=C(C(=C4)C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCC(CC2)CN3C=NC4=C3C=C(C(=C4)C)C

InChI

InChI=1S/C25H31N3O/c1-4-22(21-8-6-5-7-9-21)25(29)27-12-10-20(11-13-27)16-28-17-26-23-14-18(2)19(3)15-24(23)28/h5-9,14-15,17,20,22H,4,10-13,16H2,1-3H3