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

Systemtic Name: O1-ethyl O3-(2-oxidanylidene-2-piperidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-oxo-2-(1-piperidyl)ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: 1-O-ethyl 3-O-(2-oxo-2-piperidin-1-ylethyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-(2-keto-2-piperidino-ethyl) ester Formula: C17H20N2O7 MolecularWeight: 364.3499

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O7/c1-2-25-16(21)12-8-13(10-14(9-12)19(23)24)17(22)26-11-15(20)18-6-4-3-5-7-18/h8-10H,2-7,11H2,1H3