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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O7/c1-11-5-3-4-6-18(11)15(20)10-26-17(22)13-7-12(16(21)25-2)8-14(9-13)19(23)24/h7-9,11H,3-6,10H2,1-2H3