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

Systemtic Name: 2-[3-[4-(2-methylphenyl)piperazin-1-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(o-tolyl)piperazin-1-yl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(2-methylphenyl)-1-piperazinyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(2-methylphenyl)piperazin-1-yl]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(o-tolyl)piperazino]propyl]isoindoline-1,3-quinone Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H25N3O2/c1-17-7-2-5-10-20(17)24-15-13-23(14-16-24)11-6-12-25-21(26)18-8-3-4-9-19(18)22(25)27/h2-5,7-10H,6,11-16H2,1H3