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

Systemtic Name: 2-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(m-tolyl)piperazin-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(m-tolyl)piperazino]butyl]isoindoline-1,3-quinone Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H27N3O2/c1-18-7-6-8-19(17-18)25-15-13-24(14-16-25)11-4-5-12-26-22(27)20-9-2-3-10-21(20)23(26)28/h2-3,6-10,17H,4-5,11-16H2,1H3