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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O7/c1-11-4-3-5-18(9-11)15(20)10-26-17(22)13-6-12(16(21)25-2)7-14(8-13)19(23)24/h6-8,11H,3-5,9-10H2,1-2H3