methyl (2R)-3-(4-nitro-3-oxidanyl-phenyl)-2-(phenylmethoxycarbonylamino)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC(=C(C=C1)[N+](=O)[O-])O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H](CC1=CC(=C(C=C1)[N+](=O)[O-])O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O7/c1-26-17(22)14(9-13-7-8-15(20(24)25)16(21)10-13)19-18(23)27-11-12-5-3-2-4-6-12/h2-8,10,14,21H,9,11H2,1H3,(H,19,23)/t14-/m1/s1