3-methyl-2-phenyl-1-[4-[2-(phenylmethyl)benzimidazol-1-yl]piperidin-1-yl]butan-1-one

Systemtic Name: 3-methyl-2-phenyl-1-[4-[2-(phenylmethyl)benzimidazol-1-yl]piperidin-1-yl]butan-1-one Openeye Name: 1-[4-(2-benzylbenzimidazol-1-yl)-1-piperidyl]-3-methyl-2-phenyl-butan-1-one CAS Name: 3-methyl-2-phenyl-1-[4-[2-(phenylmethyl)-1-benzimidazolyl]-1-piperidinyl]-1-butanone IUPAC Name: 1-[4-(2-benzylbenzimidazol-1-yl)piperidin-1-yl]-3-methyl-2-phenylbutan-1-one Traditional Name: 1-[4-(2-benzylbenzimidazol-1-yl)piperidino]-3-methyl-2-phenyl-butan-1-one Formula: C30H33N3O MolecularWeight: 451.60252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)C(=O)N2CCC(CC2)N3C4=CC=CC=C4N=C3CC5=CC=CC=C5

Isomeric SMILES

CC(C)C(C1=CC=CC=C1)C(=O)N2CCC(CC2)N3C4=CC=CC=C4N=C3CC5=CC=CC=C5

InChI

InChI=1S/C30H33N3O/c1-22(2)29(24-13-7-4-8-14-24)30(34)32-19-17-25(18-20-32)33-27-16-10-9-15-26(27)31-28(33)21-23-11-5-3-6-12-23/h3-16,22,25,29H,17-21H2,1-2H3