diethyl 2,6-dimethyl-4-(1-oxidanidylpyridin-1-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2,6-dimethyl-4-(1-oxidanidylpyridin-1-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2,6-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(1-oxido-4-pyridin-1-iumyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,6-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=[N+](C=C2)[O-])C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=[N+](C=C2)[O-])C(=O)OCC)C)C

InChI

InChI=1S/C18H22N2O5/c1-5-24-17(21)14-11(3)19-12(4)15(18(22)25-6-2)16(14)13-7-9-20(23)10-8-13/h7-10,16,19H,5-6H2,1-4H3