4-[4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]sulfonylpiperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]sulfonylpiperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[4-[4-(1,3-dioxoisoindolin-2-yl)phenyl]sulfonylpiperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-[4-(1,3-dioxo-2-isoindolyl)phenyl]sulfonyl-1-piperazinyl]-4-oxobutanoate IUPAC Name: 4-[4-[4-(1,3-dioxoisoindol-2-yl)phenyl]sulfonylpiperazin-1-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[4-(4-phthalimidophenyl)sulfonylpiperazino]butyrate Formula: C22H20N3O7S- MolecularWeight: 470.4751

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N3O7S/c26-19(9-10-20(27)28)23-11-13-24(14-12-23)33(31,32)16-7-5-15(6-8-16)25-21(29)17-3-1-2-4-18(17)22(25)30/h1-8H,9-14H2,(H,27,28)/p-1