2-[4-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(4-hydroxybenzoyl)piperazin-1-yl]sulfonylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(4-hydroxybenzoyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(4-hydroxybenzoyl)piperazino]sulfonylphenyl]isoindoline-1,3-quinone Formula: C25H21N3O6S MolecularWeight: 491.51574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)O)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)O)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H21N3O6S/c29-19-9-5-17(6-10-19)23(30)26-13-15-27(16-14-26)35(33,34)20-11-7-18(8-12-20)28-24(31)21-3-1-2-4-22(21)25(28)32/h1-12,29H,13-16H2