3-methyl-2-[(3-methylphenyl)carbonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoic acid Openeye Name: 3-methyl-2-[(3-methylbenzoyl)amino]butanoic acid CAS Name: 3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[(3-methylbenzoyl)amino]butanoic acid Traditional Name: 3-methyl-2-(m-toluoylamino)butyric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-8(2)11(13(16)17)14-12(15)10-6-4-5-9(3)7-10/h4-8,11H,1-3H3,(H,14,15)(H,16,17)