(2-methoxy-2-oxidanylidene-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: (2-methoxy-2-oxo-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid (2-keto-2-methoxy-ethyl) ester Formula: C12H14N2O7 MolecularWeight: 298.24876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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