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

Systemtic Name: 2-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(2,5-dimethylphenyl)piperazino]-3-keto-propyl]isoindoline-1,3-quinone Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H25N3O3/c1-16-7-8-17(2)20(15-16)24-11-13-25(14-12-24)21(27)9-10-26-22(28)18-5-3-4-6-19(18)23(26)29/h3-8,15H,9-14H2,1-2H3