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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)OC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)C(C)OC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

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