3-[5-(4-carboxylatophenyl)sulfonyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: 3-[5-(4-carboxylatophenyl)sulfonyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: 3-[5-(4-carboxylatophenyl)sulfonyl-1,3-dioxo-isoindolin-2-yl]benzoate CAS Name: 3-[5-(4-carboxylatophenyl)sulfonyl-1,3-dioxo-2-isoindolyl]benzoate IUPAC Name: 3-[5-(4-carboxylatophenyl)sulfonyl-1,3-dioxoisoindol-2-yl]benzoate Traditional Name: 3-[5-(4-carboxylatophenyl)sulfonyl-1,3-diketo-isoindolin-2-yl]benzoate Formula: C22H11NO8S-2 MolecularWeight: 449.38964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H13NO8S/c24-19-17-9-8-16(32(30,31)15-6-4-12(5-7-15)21(26)27)11-18(17)20(25)23(19)14-3-1-2-13(10-14)22(28)29/h1-11H,(H,26,27)(H,28,29)/p-2