(1-azanyl-1-oxidanylidene-propan-2-yl) 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 3-methyl-2-[(3-methylbenzoyl)amino]butanoate CAS Name: 3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 3-methyl-2-[(3-methylbenzoyl)amino]butanoate Traditional Name: 3-methyl-2-(m-toluoylamino)butyric acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-9(2)13(16(21)22-11(4)14(17)19)18-15(20)12-7-5-6-10(3)8-12/h5-9,11,13H,1-4H3,(H2,17,19)(H,18,20)