(2-oxidanylidene-2-phenylazanyl-ethyl) 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: (2-anilino-2-oxo-ethyl) 3-methyl-2-[(3-methylbenzoyl)amino]butanoate CAS Name: 3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 3-methyl-2-[(3-methylbenzoyl)amino]butanoate Traditional Name: 3-methyl-2-(m-toluoylamino)butyric acid (2-anilino-2-keto-ethyl) ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O4/c1-14(2)19(23-20(25)16-9-7-8-15(3)12-16)21(26)27-13-18(24)22-17-10-5-4-6-11-17/h4-12,14,19H,13H2,1-3H3,(H,22,24)(H,23,25)