1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-phenyl-3-[1-(phenylmethyl)indol-3-yl]butan-1-one

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-phenyl-3-[1-(phenylmethyl)indol-3-yl]butan-1-one Openeye Name: 3-(1-benzylindol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-4-phenyl-3-[1-(phenylmethyl)-3-indolyl]-1-butanone IUPAC Name: 3-(1-benzylindol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-phenylbutan-1-one Traditional Name: 3-(1-benzylindol-3-yl)-1-[4-(4-methoxyphenyl)piperazino]-4-phenyl-butan-1-one Formula: C36H37N3O2 MolecularWeight: 543.69788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C36H37N3O2/c1-41-32-18-16-31(17-19-32)37-20-22-38(23-21-37)36(40)25-30(24-28-10-4-2-5-11-28)34-27-39(26-29-12-6-3-7-13-29)35-15-9-8-14-33(34)35/h2-19,27,30H,20-26H2,1H3