2-cyclopentyl-4-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-cyclopentyl-4-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-cyclopentyl-4-[4-[3-(p-tolyl)propanoyl]piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-cyclopentyl-4-[4-[3-(4-methylphenyl)-1-oxopropyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-cyclopentyl-4-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-cyclopentyl-4-[4-[3-(p-tolyl)propanoyl]piperazino]isoindoline-1,3-quinone Formula: C27H31N3O3 MolecularWeight: 445.55334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCC5

InChI

InChI=1S/C27H31N3O3/c1-19-9-11-20(12-10-19)13-14-24(31)29-17-15-28(16-18-29)23-8-4-7-22-25(23)27(33)30(26(22)32)21-5-2-3-6-21/h4,7-12,21H,2-3,5-6,13-18H2,1H3