O1-methyl O3-(2-oxidanylidene-2-piperidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-(2-oxidanylidene-2-piperidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[2-oxo-2-(1-piperidyl)ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: 1-O-methyl 3-O-(2-oxo-2-piperidin-1-ylethyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(2-keto-2-piperidino-ethyl) ester O1-methyl ester Formula: C16H18N2O7 MolecularWeight: 350.32332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)N2CCCCC2

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)N2CCCCC2

InChI

InChI=1S/C16H18N2O7/c1-24-15(20)11-7-12(9-13(8-11)18(22)23)16(21)25-10-14(19)17-5-3-2-4-6-17/h7-9H,2-6,10H2,1H3