3-(1-methylindol-3-yl)-3-(4-methylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1-methylindol-3-yl)-3-(4-methylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(1-methylindol-3-yl)-3-(p-tolyl)propan-1-one CAS Name: 3-(1-methyl-3-indolyl)-3-(4-methylphenyl)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(1-methylindol-3-yl)-3-(4-methylphenyl)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-(1-methylindol-3-yl)-3-(p-tolyl)propan-1-one Formula: C30H33N3O MolecularWeight: 451.60252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)C

InChI

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