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

Systemtic Name: 2-[1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-benzyl-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-benzyl-2-[4-(2,3-dimethylphenyl)piperazino]-2-keto-ethyl]isoindoline-1,3-quinone Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O)C

InChI

InChI=1S/C29H29N3O3/c1-20-9-8-14-25(21(20)2)30-15-17-31(18-16-30)29(35)26(19-22-10-4-3-5-11-22)32-27(33)23-12-6-7-13-24(23)28(32)34/h3-14,26H,15-19H2,1-2H3