2-[4-[4-(3-ethanoylphenyl)sulfonylpiperazin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(3-ethanoylphenyl)sulfonylpiperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(3-acetylphenyl)sulfonylpiperazin-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(3-acetylphenyl)sulfonyl-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(3-acetylphenyl)sulfonylpiperazin-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(3-acetylphenyl)sulfonylpiperazino]butyl]isoindoline-1,3-quinone Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27N3O5S/c1-18(28)19-7-6-8-20(17-19)33(31,32)26-15-13-25(14-16-26)11-4-5-12-27-23(29)21-9-2-3-10-22(21)24(27)30/h2-3,6-10,17H,4-5,11-16H2,1H3