2-[[4-[4-[(2-carboxy-4-oxidanyl-phenyl)carbamoyl]phenyl]sulfonylphenyl]carbonylamino]-5-oxidanyl-benzoic acid

Systemtic Name: 2-[[4-[4-[(2-carboxy-4-oxidanyl-phenyl)carbamoyl]phenyl]sulfonylphenyl]carbonylamino]-5-oxidanyl-benzoic acid Openeye Name: 2-[[4-[4-[(2-carboxy-4-hydroxy-phenyl)carbamoyl]phenyl]sulfonylbenzoyl]amino]-5-hydroxy-benzoic acid CAS Name: 2-[[[4-[4-[(2-carboxy-4-hydroxyanilino)-oxomethyl]phenyl]sulfonylphenyl]-oxomethyl]amino]-5-hydroxybenzoic acid IUPAC Name: 2-[[4-[4-[(2-carboxy-4-hydroxyphenyl)carbamoyl]phenyl]sulfonylbenzoyl]amino]-5-hydroxybenzoic acid Traditional Name: 2-[[4-[4-[(2-carboxy-4-hydroxy-phenyl)carbamoyl]phenyl]sulfonylbenzoyl]amino]-5-hydroxy-benzoic acid Formula: C28H20N2O10S MolecularWeight: 576.5308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)O)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=C(C=C(C=C4)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)O)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=C(C=C(C=C4)O)C(=O)O

InChI

InChI=1S/C28H20N2O10S/c31-17-5-11-23(21(13-17)27(35)36)29-25(33)15-1-7-19(8-2-15)41(39,40)20-9-3-16(4-10-20)26(34)30-24-12-6-18(32)14-22(24)28(37)38/h1-14,31-32H,(H,29,33)(H,30,34)(H,35,36)(H,37,38)