3-(1-methylindol-3-yl)-3-(3-methylphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1-methylindol-3-yl)-3-(3-methylphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[(E)-cinnamyl]piperazin-1-yl]-3-(1-methylindol-3-yl)-3-(m-tolyl)propan-1-one CAS Name: 3-(1-methyl-3-indolyl)-3-(3-methylphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(1-methylindol-3-yl)-3-(3-methylphenyl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[(E)-cinnamyl]piperazino]-3-(1-methylindol-3-yl)-3-(m-tolyl)propan-1-one Formula: C32H35N3O MolecularWeight: 477.6398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H35N3O/c1-25-10-8-14-27(22-25)29(30-24-33(2)31-16-7-6-15-28(30)31)23-32(36)35-20-18-34(19-21-35)17-9-13-26-11-4-3-5-12-26/h3-16,22,24,29H,17-21,23H2,1-2H3/b13-9+