2-[5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentyl]isoindole-1,3-dione

Systemtic Name: 2-[5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentyl]isoindole-1,3-dione Openeye Name: 2-[5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentyl]isoindoline-1,3-dione CAS Name: 2-[5-[4-(2,3-dimethylphenyl)-1-piperazinyl]pentyl]isoindole-1,3-dione IUPAC Name: 2-[5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentyl]isoindole-1,3-dione Traditional Name: 2-[5-[4-(2,3-dimethylphenyl)piperazino]pentyl]isoindoline-1,3-quinone Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)CCCCCN3C(=O)C4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)CCCCCN3C(=O)C4=CC=CC=C4C3=O)C

InChI

InChI=1S/C25H31N3O2/c1-19-9-8-12-23(20(19)2)27-17-15-26(16-18-27)13-6-3-7-14-28-24(29)21-10-4-5-11-22(21)25(28)30/h4-5,8-12H,3,6-7,13-18H2,1-2H3