(phenylmethyl) 2-[(4-nitrophenyl)methoxycarbonylamino]-3-oxidanyl-propanoate

Systemtic Name: (phenylmethyl) 2-[(4-nitrophenyl)methoxycarbonylamino]-3-oxidanyl-propanoate Openeye Name: benzyl 3-hydroxy-2-[(4-nitrophenyl)methoxycarbonylamino]propanoate CAS Name: 3-hydroxy-2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-hydroxy-2-[(4-nitrophenyl)methoxycarbonylamino]propanoate Traditional Name: 3-hydroxy-2-[(4-nitrobenzyl)oxycarbonylamino]propionic acid benzyl ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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