3-(4-fluorophenyl)-3-(1-methylindol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-fluorophenyl)-3-(1-methylindol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-fluorophenyl)-3-(1-methylindol-3-yl)-1-[4-(o-tolyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-fluorophenyl)-3-(1-methyl-3-indolyl)-1-[4-(2-methylphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-fluorophenyl)-3-(1-methylindol-3-yl)-1-[4-(2-methylphenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(4-fluorophenyl)-3-(1-methylindol-3-yl)-1-[4-(o-tolyl)piperazino]propan-1-one Formula: C29H30FN3O MolecularWeight: 455.566403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)CC(C3=CC=C(C=C3)F)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)CC(C3=CC=C(C=C3)F)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C29H30FN3O/c1-21-7-3-5-9-27(21)32-15-17-33(18-16-32)29(34)19-25(22-11-13-23(30)14-12-22)26-20-31(2)28-10-6-4-8-24(26)28/h3-14,20,25H,15-19H2,1-2H3