2-(dimethoxymethyl)-6-methyl-4-(2-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2-(dimethoxymethyl)-6-methyl-4-(2-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2-(dimethoxymethyl)-6-methyl-4-(2-methyl-1-oxido-pyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2-(dimethoxymethyl)-6-methyl-4-(2-methyl-1-oxido-3-pyridin-1-iumyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2-(dimethoxymethyl)-6-methyl-4-(2-methyl-1-oxidopyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2-(dimethoxymethyl)-6-methyl-4-(2-methyl-1-oxido-pyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C17H20N2O7 MolecularWeight: 364.3499

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O7/c1-8-11(15(20)21)12(10-6-5-7-19(24)9(10)2)13(16(22)23)14(18-8)17(25-3)26-4/h5-7,12,17-18H,1-4H3,(H,20,21)(H,22,23)