3-[1-[(2-methylphenyl)methyl]piperidin-3-yl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-[1-[(2-methylphenyl)methyl]piperidin-3-yl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-[1-(o-tolylmethyl)-3-piperidyl]propan-1-one CAS Name: 3-[1-[(2-methylphenyl)methyl]-3-piperidinyl]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-[1-[(2-methylphenyl)methyl]piperidin-3-yl]propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-[1-(2-methylbenzyl)-3-piperidyl]propan-1-one Formula: C27H37N3O MolecularWeight: 419.60218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCC(C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2CCCC(C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H37N3O/c1-23-8-5-6-12-26(23)22-29-15-7-11-25(21-29)13-14-27(31)30-18-16-28(17-19-30)20-24-9-3-2-4-10-24/h2-6,8-10,12,25H,7,11,13-22H2,1H3