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

Systemtic Name: 3-[1-[(3-ethanoylphenyl)methyl]piperidin-3-yl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-[1-[(3-acetylphenyl)methyl]-3-piperidyl]-1-(4-benzylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-[(3-acetylphenyl)methyl]-3-piperidinyl]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[1-[(3-acetylphenyl)methyl]piperidin-3-yl]-1-(4-benzylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-(3-acetylbenzyl)-3-piperidyl]-1-(4-benzylpiperazino)propan-1-one Formula: C28H37N3O2 MolecularWeight: 447.61228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37N3O2/c1-23(32)27-11-5-9-26(19-27)22-30-14-6-10-25(21-30)12-13-28(33)31-17-15-29(16-18-31)20-24-7-3-2-4-8-24/h2-5,7-9,11,19,25H,6,10,12-18,20-22H2,1H3