[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] (2S)-2-[(4-chlorobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] (2S)-2-[(4-chlorobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(4-chlorobenzoyl)amino]propionic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C13H15ClN2O4 MolecularWeight: 298.7222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)N)NC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

C[C@@H](C(=O)O[C@H](C)C(=O)N)NC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H15ClN2O4/c1-7(13(19)20-8(2)11(15)17)16-12(18)9-3-5-10(14)6-4-9/h3-8H,1-2H3,(H2,15,17)(H,16,18)/t7-,8+/m0/s1