methyl 2-[[(1R,2R)-1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[[(1R,2R)-1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]amino]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]amino]-2-oxo-acetate CAS Name: 2-[[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]amino]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]amino]-2-oxoacetate Traditional Name: 2-[[(1R,2R)-2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]amino]-2-keto-acetic acid methyl ester Formula: C12H14N2O7 MolecularWeight: 298.24876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O7/c1-21-12(18)11(17)13-9(6-15)10(16)7-2-4-8(5-3-7)14(19)20/h2-5,9-10,15-16H,6H2,1H3,(H,13,17)/t9-,10-/m1/s1