3-(2,2-dimethylpropanoylamino)-2,4-bis(oxidanyl)benzoic acid

Systemtic Name: 3-(2,2-dimethylpropanoylamino)-2,4-bis(oxidanyl)benzoic acid Openeye Name: 3-(2,2-dimethylpropanoylamino)-2,4-dihydroxy-benzoic acid CAS Name: 3-[(2,2-dimethyl-1-oxopropyl)amino]-2,4-dihydroxybenzoic acid IUPAC Name: 3-(2,2-dimethylpropanoylamino)-2,4-dihydroxybenzoic acid Traditional Name: 2,4-dihydroxy-3-(pivaloylamino)benzoic acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=CC(=C1O)C(=O)O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=CC(=C1O)C(=O)O)O

InChI

InChI=1S/C12H15NO5/c1-12(2,3)11(18)13-8-7(14)5-4-6(9(8)15)10(16)17/h4-5,14-15H,1-3H3,(H,13,18)(H,16,17)