1-[2-(3-methylphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidin-1-yl]ethanone

Systemtic Name: 1-[2-(3-methylphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidin-1-yl]ethanone Openeye Name: 1-[5-(4-benzylpiperazine-1-carbonyl)-2-(m-tolyl)-1-piperidyl]ethanone CAS Name: 1-[2-(3-methylphenyl)-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-piperidinyl]ethanone IUPAC Name: 1-[5-(4-benzylpiperazine-1-carbonyl)-2-(3-methylphenyl)piperidin-1-yl]ethanone Traditional Name: 1-[5-(4-benzylpiperazine-1-carbonyl)-2-(m-tolyl)piperidino]ethanone Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCC(CN2C(=O)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2CCC(CN2C(=O)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O2/c1-20-7-6-10-23(17-20)25-12-11-24(19-29(25)21(2)30)26(31)28-15-13-27(14-16-28)18-22-8-4-3-5-9-22/h3-10,17,24-25H,11-16,18-19H2,1-2H3