4-[2-(3-methoxycarbonylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]sulfonylbenzoic acid

Systemtic Name: 4-[2-(3-methoxycarbonylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]sulfonylbenzoic acid Openeye Name: 4-[2-(3-methoxycarbonylphenyl)-1,3-dioxo-isoindolin-5-yl]sulfonylbenzoic acid CAS Name: 4-[[2-(3-methoxycarbonylphenyl)-1,3-dioxo-5-isoindolyl]sulfonyl]benzoic acid IUPAC Name: 4-[2-(3-methoxycarbonylphenyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid Traditional Name: 4-[2-(3-carbomethoxyphenyl)-1,3-diketo-isoindolin-5-yl]sulfonylbenzoic acid Formula: C23H15NO8S MolecularWeight: 465.4321

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)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

Isomeric SMILES

COC(=O)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

InChI

InChI=1S/C23H15NO8S/c1-32-23(29)14-3-2-4-15(11-14)24-20(25)18-10-9-17(12-19(18)21(24)26)33(30,31)16-7-5-13(6-8-16)22(27)28/h2-12H,1H3,(H,27,28)