3,4-bis[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid

Systemtic Name: 3,4-bis[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid Openeye Name: 3,4-bis[(4-hydroxy-4-oxo-butanoyl)amino]benzoic acid CAS Name: 3,4-bis[(4-hydroxy-1,4-dioxobutyl)amino]benzoic acid IUPAC Name: 3,4-bis[(4-hydroxy-4-oxobutanoyl)amino]benzoic acid Traditional Name: 3,4-bis[(4-hydroxy-4-keto-butanoyl)amino]benzoic acid Formula: C15H16N2O8 MolecularWeight: 352.29614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)CCC(=O)O)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)CCC(=O)O)NC(=O)CCC(=O)O

InChI

InChI=1S/C15H16N2O8/c18-11(3-5-13(20)21)16-9-2-1-8(15(24)25)7-10(9)17-12(19)4-6-14(22)23/h1-2,7H,3-6H2,(H,16,18)(H,17,19)(H,20,21)(H,22,23)(H,24,25)