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

Systemtic Name: 4-[2-(4-carboxyphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylbenzoic acid Openeye Name: 4-[2-(4-carboxyphenyl)-1,3-dioxo-isoindoline-5-carbonyl]benzoic acid CAS Name: 4-[[2-(4-carboxyphenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]benzoic acid IUPAC Name: 4-[2-(4-carboxyphenyl)-1,3-dioxoisoindole-5-carbonyl]benzoic acid Traditional Name: 4-[2-(4-carboxyphenyl)-1,3-diketo-isoindoline-5-carbonyl]benzoic acid Formula: C23H13NO7 MolecularWeight: 415.35182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C23H13NO7/c25-19(12-1-3-13(4-2-12)22(28)29)15-7-10-17-18(11-15)21(27)24(20(17)26)16-8-5-14(6-9-16)23(30)31/h1-11H,(H,28,29)(H,30,31)