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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(C)N3C(=O)C4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)[C@H](C)N3C(=O)C4=CC=CC=C4C3=O)C

InChI

InChI=1S/C23H25N3O3/c1-15-7-6-10-20(16(15)2)24-11-13-25(14-12-24)21(27)17(3)26-22(28)18-8-4-5-9-19(18)23(26)29/h4-10,17H,11-14H2,1-3H3/t17-/m0/s1