2-[(2-methyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid

Systemtic Name: 2-[(2-methyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]benzoic acid Openeye Name: 2-[(4-hydroxy-2-methyl-4-oxo-butanoyl)amino]benzoic acid CAS Name: 2-[(4-hydroxy-2-methyl-1,4-dioxobutyl)amino]benzoic acid IUPAC Name: 2-[(4-hydroxy-2-methyl-4-oxobutanoyl)amino]benzoic acid Traditional Name: 2-[(4-hydroxy-4-keto-2-methyl-butanoyl)amino]benzoic acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(=O)NC1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(CC(=O)O)C(=O)NC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C12H13NO5/c1-7(6-10(14)15)11(16)13-9-5-3-2-4-8(9)12(17)18/h2-5,7H,6H2,1H3,(H,13,16)(H,14,15)(H,17,18)