5-[3-carboxy-4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]-2-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid

Systemtic Name: 5-[3-carboxy-4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]-2-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid Openeye Name: 5-[3-carboxy-4-[(4-hydroxy-4-oxo-butanoyl)amino]phenyl]-2-[(4-hydroxy-4-oxo-butanoyl)amino]benzoic acid CAS Name: 5-[3-carboxy-4-[(4-hydroxy-1,4-dioxobutyl)amino]phenyl]-2-[(4-hydroxy-1,4-dioxobutyl)amino]benzoic acid IUPAC Name: 5-[3-carboxy-4-[(4-hydroxy-4-oxobutanoyl)amino]phenyl]-2-[(4-hydroxy-4-oxobutanoyl)amino]benzoic acid Traditional Name: 5-[3-carboxy-4-[(4-hydroxy-4-keto-butanoyl)amino]phenyl]-2-[(4-hydroxy-4-keto-butanoyl)amino]benzoic acid Formula: C22H20N2O10 MolecularWeight: 472.4016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC(=C(C=C2)NC(=O)CCC(=O)O)C(=O)O)C(=O)O)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=CC(=C(C=C2)NC(=O)CCC(=O)O)C(=O)O)C(=O)O)NC(=O)CCC(=O)O

InChI

InChI=1S/C22H20N2O10/c25-17(5-7-19(27)28)23-15-3-1-11(9-13(15)21(31)32)12-2-4-16(14(10-12)22(33)34)24-18(26)6-8-20(29)30/h1-4,9-10H,5-8H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)(H,31,32)(H,33,34)