O1-methyl O3-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-(1-methyl-2-morpholino-2-oxo-ethyl) 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-methyl 3-O-(1-morpholin-4-yl-1-oxopropan-2-yl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(2-keto-1-methyl-2-morpholino-ethyl) ester O1-methyl ester Formula: C16H18N2O8 MolecularWeight: 366.32272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O8/c1-10(14(19)17-3-5-25-6-4-17)26-16(21)12-7-11(15(20)24-2)8-13(9-12)18(22)23/h7-10H,3-6H2,1-2H3