[(2R)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(3-methylphenyl)carbonylamino]ethanoate

Systemtic Name: [(2R)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(3-methylphenyl)carbonylamino]ethanoate Openeye Name: [(1R)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl] 2-[(3-methylbenzoyl)amino]acetate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid [(2R)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] 2-[(3-methylbenzoyl)amino]acetate Traditional Name: 2-(m-toluoylamino)acetic acid [(1R)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)OC(=O)CNC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4/c1-13-6-5-7-17(10-13)21(25)22-12-19(23)26-16(4)20(24)18-11-14(2)8-9-15(18)3/h5-11,16H,12H2,1-4H3,(H,22,25)/t16-/m1/s1