(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (1-methyl-2-morpholino-2-oxo-ethyl) 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid [1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopropan-2-yl) 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-keto-1-methyl-2-morpholino-ethyl) ester Formula: C16H20N2O8 MolecularWeight: 368.3386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)OC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(C(=O)N1CCOCC1)OC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C16H20N2O8/c1-10(15(19)17-4-6-25-7-5-17)26-16(20)11-8-13(23-2)14(24-3)9-12(11)18(21)22/h8-10H,4-7H2,1-3H3