[4-[(2S)-3-azanyl-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]phenyl] 2-chloranylethanoate

Systemtic Name: [4-[(2S)-3-azanyl-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propyl]phenyl] 2-chloranylethanoate Openeye Name: [4-[(2S)-3-amino-2-(benzyloxycarbonylamino)-3-oxo-propyl]phenyl] 2-chloroacetate CAS Name: 2-chloroacetic acid [4-[(2S)-3-amino-3-oxo-2-(phenylmethoxycarbonylamino)propyl]phenyl] ester IUPAC Name: [4-[(2S)-3-amino-3-oxo-2-(phenylmethoxycarbonylamino)propyl]phenyl] 2-chloroacetate Traditional Name: 2-chloroacetic acid [4-[(2S)-3-amino-2-(benzyloxycarbonylamino)-3-keto-propyl]phenyl] ester Formula: C19H19ClN2O5 MolecularWeight: 390.81756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)OC(=O)CCl)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CC2=CC=C(C=C2)OC(=O)CCl)C(=O)N

InChI

InChI=1S/C19H19ClN2O5/c20-11-17(23)27-15-8-6-13(7-9-15)10-16(18(21)24)22-19(25)26-12-14-4-2-1-3-5-14/h1-9,16H,10-12H2,(H2,21,24)(H,22,25)/t16-/m0/s1