(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]butanoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) (2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(p-toluoylamino)butyric acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4/c1-13(2)17(23-20(25)16-11-9-14(3)10-12-16)21(26)27-18(19(22)24)15-7-5-4-6-8-15/h4-13,17-18H,1-3H3,(H2,22,24)(H,23,25)/t17-,18?/m0/s1