[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(4-chlorophenyl)carbonylamino]ethanoate

Systemtic Name: [(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(4-chlorophenyl)carbonylamino]ethanoate Openeye Name: [(1S)-2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 2-[(4-chlorobenzoyl)amino]acetate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]acetic acid [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] 2-[(4-chlorobenzoyl)amino]acetate Traditional Name: 2-[(4-chlorobenzoyl)amino]acetic acid [(1S)-2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)CNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H20ClNO4/c1-3-14-4-6-15(7-5-14)19(24)13(2)26-18(23)12-22-20(25)16-8-10-17(21)11-9-16/h4-11,13H,3,12H2,1-2H3,(H,22,25)/t13-/m0/s1