3-methyl-2-(2-methylpropanoylamino)benzoate

Systemtic Name: 3-methyl-2-(2-methylpropanoylamino)benzoate Openeye Name: 3-methyl-2-(2-methylpropanoylamino)benzoate CAS Name: 3-methyl-2-[(2-methyl-1-oxopropyl)amino]benzoate IUPAC Name: 3-methyl-2-(2-methylpropanoylamino)benzoate Traditional Name: 2-(isobutyrylamino)-3-methyl-benzoate Formula: C12H14NO3- MolecularWeight: 220.24446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=O)C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1NC(=O)C(C)C)C(=O)[O-]

InChI

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