(2-morpholin-4-yl-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C15H18N2O8 MolecularWeight: 354.31202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N2CCOCC2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N2CCOCC2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H18N2O8/c1-22-12-7-10(11(17(20)21)8-13(12)23-2)15(19)25-9-14(18)16-3-5-24-6-4-16/h7-8H,3-6,9H2,1-2H3