4-methyl-3-(2-methylpropanoylamino)benzoic acid

Systemtic Name: 4-methyl-3-(2-methylpropanoylamino)benzoic acid Openeye Name: 4-methyl-3-(2-methylpropanoylamino)benzoic acid CAS Name: 4-methyl-3-[(2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 4-methyl-3-(2-methylpropanoylamino)benzoic acid Traditional Name: 3-(isobutyrylamino)-4-methyl-benzoic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-7(2)11(14)13-10-6-9(12(15)16)5-4-8(10)3/h4-7H,1-3H3,(H,13,14)(H,15,16)