O1-ethyl O3-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-(4-methyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: 1-O-ethyl 3-O-[2-(4-methylpiperidin-1-yl)-2-oxoethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-keto-2-(4-methylpiperidino)ethyl] ester Formula: C18H22N2O7 MolecularWeight: 378.37648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)N2CCC(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)N2CCC(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O7/c1-3-26-17(22)13-8-14(10-15(9-13)20(24)25)18(23)27-11-16(21)19-6-4-12(2)5-7-19/h8-10,12H,3-7,11H2,1-2H3