[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate

Systemtic Name: [1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate Openeye Name: [2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl] (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]butanoic acid [1-(3-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-chlorophenyl)-1-oxopropan-2-yl] (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(p-toluoylamino)butyric acid [2-(3-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H24ClNO4 MolecularWeight: 401.88326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)OC(C)C(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C22H24ClNO4/c1-13(2)19(24-21(26)16-10-8-14(3)9-11-16)22(27)28-15(4)20(25)17-6-5-7-18(23)12-17/h5-13,15,19H,1-4H3,(H,24,26)/t15?,19-/m0/s1