(2,6-dimethylphenyl) (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate

Systemtic Name: (2,6-dimethylphenyl) (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate Openeye Name: (2,6-dimethylphenyl) (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]butanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(o-toluoylamino)butyric acid (2,6-dimethylphenyl) ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)[C@H](C(C)C)NC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C21H25NO3/c1-13(2)18(22-20(23)17-12-7-6-9-14(17)3)21(24)25-19-15(4)10-8-11-16(19)5/h6-13,18H,1-5H3,(H,22,23)/t18-/m0/s1