4-[(2,3-dimethyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid

Systemtic Name: 4-[(2,3-dimethyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid Openeye Name: 4-[(4-hydroxy-2,3-dimethyl-4-oxo-butanoyl)amino]benzoic acid CAS Name: 4-[(4-hydroxy-2,3-dimethyl-1,4-dioxobutyl)amino]benzoic acid IUPAC Name: 4-[(4-hydroxy-2,3-dimethyl-4-oxobutanoyl)amino]benzoic acid Traditional Name: 4-[(4-hydroxy-4-keto-2,3-dimethyl-butanoyl)amino]benzoic acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)C(=O)O)C(=O)NC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C(C)C(=O)O)C(=O)NC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C13H15NO5/c1-7(8(2)12(16)17)11(15)14-10-5-3-9(4-6-10)13(18)19/h3-8H,1-2H3,(H,14,15)(H,16,17)(H,18,19)