[(2S)-1-chloranyl-3-(phenylmethoxycarbonylamino)propan-2-yl] ethanoate

Systemtic Name: [(2S)-1-chloranyl-3-(phenylmethoxycarbonylamino)propan-2-yl] ethanoate Openeye Name: [(1S)-1-(benzyloxycarbonylaminomethyl)-2-chloro-ethyl] acetate CAS Name: acetic acid [(2S)-1-chloro-3-(phenylmethoxycarbonylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-chloro-3-(phenylmethoxycarbonylamino)propan-2-yl] acetate Traditional Name: acetic acid [(1S)-1-(benzyloxycarbonylaminomethyl)-2-chloro-ethyl] ester Formula: C13H16ClNO4 MolecularWeight: 285.72344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CNC(=O)OCC1=CC=CC=C1)CCl

Isomeric SMILES

CC(=O)O[C@@H](CNC(=O)OCC1=CC=CC=C1)CCl

InChI

InChI=1S/C13H16ClNO4/c1-10(16)19-12(7-14)8-15-13(17)18-9-11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3,(H,15,17)/t12-/m1/s1