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

Systemtic Name: dimethyl 2,6-dimethyl-4-(1-oxidanidylpyridin-1-ium-3-yl)pyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-(1-oxidopyridin-1-ium-3-yl)pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(1-oxido-3-pyridin-1-iumyl)pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-dimethyl-4-(1-oxidopyridin-1-ium-3-yl)pyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(1-oxidopyridin-1-ium-3-yl)pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)OC)C2=C[N+](=CC=C2)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)OC)C2=C[N+](=CC=C2)[O-])C(=O)OC

InChI

InChI=1S/C16H16N2O5/c1-9-12(15(19)22-3)14(11-6-5-7-18(21)8-11)13(10(2)17-9)16(20)23-4/h5-8H,1-4H3