2-[4-[4-[2-(2-oxidanylphenoxy)ethanoyl]piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-[2-(2-oxidanylphenoxy)ethanoyl]piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-[2-(2-hydroxyphenoxy)acetyl]piperazin-1-yl]sulfonylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[[4-[2-(2-hydroxyphenoxy)-1-oxoethyl]-1-piperazinyl]sulfonyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-[2-(2-hydroxyphenoxy)acetyl]piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-[2-(2-hydroxyphenoxy)acetyl]piperazino]sulfonylphenyl]isoindoline-1,3-quinone Formula: C26H23N3O7S MolecularWeight: 521.54172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=CC=C2O)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=CC=C2O)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H23N3O7S/c30-22-7-3-4-8-23(22)36-17-24(31)27-13-15-28(16-14-27)37(34,35)19-11-9-18(10-12-19)29-25(32)20-5-1-2-6-21(20)26(29)33/h1-12,30H,13-17H2