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

Systemtic Name: 5-[[3-carboxy-4-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]phenyl]methyl]-2-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid Openeye Name: 5-[[3-carboxy-4-[(4-hydroxy-4-oxo-butanoyl)amino]phenyl]methyl]-2-[(4-hydroxy-4-oxo-butanoyl)amino]benzoic acid CAS Name: 5-[[3-carboxy-4-[(4-hydroxy-1,4-dioxobutyl)amino]phenyl]methyl]-2-[(4-hydroxy-1,4-dioxobutyl)amino]benzoic acid IUPAC Name: 5-[[3-carboxy-4-[(4-hydroxy-4-oxobutanoyl)amino]phenyl]methyl]-2-[(4-hydroxy-4-oxobutanoyl)amino]benzoic acid Traditional Name: 5-[3-carboxy-4-[(4-hydroxy-4-keto-butanoyl)amino]benzyl]-2-[(4-hydroxy-4-keto-butanoyl)amino]benzoic acid Formula: C23H22N2O10 MolecularWeight: 486.42818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2=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=C1CC2=CC(=C(C=C2)NC(=O)CCC(=O)O)C(=O)O)C(=O)O)NC(=O)CCC(=O)O

InChI

InChI=1S/C23H22N2O10/c26-18(5-7-20(28)29)24-16-3-1-12(10-14(16)22(32)33)9-13-2-4-17(15(11-13)23(34)35)25-19(27)6-8-21(30)31/h1-4,10-11H,5-9H2,(H,24,26)(H,25,27)(H,28,29)(H,30,31)(H,32,33)(H,34,35)