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

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 3-methyl-2-[(3-methylbenzoyl)amino]butanoate CAS Name: 3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 3-methyl-2-[(3-methylbenzoyl)amino]butanoate Traditional Name: 3-methyl-2-(m-toluoylamino)butyric acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C22H25NO4 MolecularWeight: 367.4382

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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)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OC(C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H25NO4/c1-14(2)19(23-21(25)18-12-8-9-15(3)13-18)22(26)27-16(4)20(24)17-10-6-5-7-11-17/h5-14,16,19H,1-4H3,(H,23,25)