(4-nitrophenyl)methyl (2R)-3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (4-nitrophenyl)methyl (2R)-3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (4-nitrophenyl)methyl (2R)-2-(benzyloxycarbonylamino)-3-hydroxy-propanoate CAS Name: (2R)-3-hydroxy-2-(phenylmethoxycarbonylamino)propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2R)-3-hydroxy-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2R)-2-(benzyloxycarbonylamino)-3-hydroxy-propionic acid (4-nitrobenzyl) ester Formula: C18H18N2O7 MolecularWeight: 374.34472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CO)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@H](CO)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O7/c21-10-16(19-18(23)27-12-13-4-2-1-3-5-13)17(22)26-11-14-6-8-15(9-7-14)20(24)25/h1-9,16,21H,10-12H2,(H,19,23)/t16-/m1/s1