2-[(2S,3S)-3-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)pentan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2S,3S)-3-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)pentan-2-yl]isoindole-1,3-dione Openeye Name: 2-[(1S,2S)-2-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]isoindoline-1,3-dione CAS Name: 2-[(2S,3S)-3-methyl-1-oxo-1-(4-phenyl-1-piperazinyl)pentan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[(2S,3S)-3-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]isoindole-1,3-dione Traditional Name: 2-[(1S,2S)-2-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]isoindoline-1,3-quinone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27N3O3/c1-3-17(2)21(27-22(28)19-11-7-8-12-20(19)23(27)29)24(30)26-15-13-25(14-16-26)18-9-5-4-6-10-18/h4-12,17,21H,3,13-16H2,1-2H3/t17-,21-/m0/s1