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

Systemtic Name: 3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-[1-[(4-methoxyphenyl)methyl]-3-piperidyl]propan-1-one CAS Name: 3-[1-[(4-methoxyphenyl)methyl]-3-piperidinyl]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-(1-p-anisyl-3-piperidyl)propan-1-one Formula: C27H37N3O2 MolecularWeight: 435.60158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCC(C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCC(C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H37N3O2/c1-32-26-12-9-25(10-13-26)22-29-15-5-8-24(21-29)11-14-27(31)30-18-16-28(17-19-30)20-23-6-3-2-4-7-23/h2-4,6-7,9-10,12-13,24H,5,8,11,14-22H2,1H3