3-(2,2-dimethylpropanoylamino)-4-methyl-benzoic acid

Systemtic Name: 3-(2,2-dimethylpropanoylamino)-4-methyl-benzoic acid Openeye Name: 3-(2,2-dimethylpropanoylamino)-4-methyl-benzoic acid CAS Name: 3-[(2,2-dimethyl-1-oxopropyl)amino]-4-methylbenzoic acid IUPAC Name: 3-(2,2-dimethylpropanoylamino)-4-methylbenzoic acid Traditional Name: 4-methyl-3-(pivaloylamino)benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C(C)(C)C

InChI

InChI=1S/C13H17NO3/c1-8-5-6-9(11(15)16)7-10(8)14-12(17)13(2,3)4/h5-7H,1-4H3,(H,14,17)(H,15,16)