(4-ethanoylphenyl) (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate

Systemtic Name: (4-ethanoylphenyl) (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate Openeye Name: (4-acetylphenyl) (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]butanoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(o-toluoylamino)butyric acid (4-acetylphenyl) ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)OC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C21H23NO4/c1-13(2)19(22-20(24)18-8-6-5-7-14(18)3)21(25)26-17-11-9-16(10-12-17)15(4)23/h5-13,19H,1-4H3,(H,22,24)/t19-/m0/s1