5-(3,3-dimethylbutanoylamino)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(3,3-dimethylbutanoylamino)-2-oxidanyl-benzoic acid Openeye Name: 5-(3,3-dimethylbutanoylamino)-2-hydroxy-benzoic acid CAS Name: 5-[(3,3-dimethyl-1-oxobutyl)amino]-2-hydroxybenzoic acid IUPAC Name: 5-(3,3-dimethylbutanoylamino)-2-hydroxybenzoic acid Traditional Name: 5-(3,3-dimethylbutanoylamino)-2-hydroxy-benzoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-13(2,3)7-11(16)14-8-4-5-10(15)9(6-8)12(17)18/h4-6,15H,7H2,1-3H3,(H,14,16)(H,17,18)