[4-methyl-2-(1-methylpyridin-1-ium-3-yl)carbonyloxy-phenyl] 1-methylpyridin-1-ium-3-carboxylate

Systemtic Name: [4-methyl-2-(1-methylpyridin-1-ium-3-yl)carbonyloxy-phenyl] 1-methylpyridin-1-ium-3-carboxylate Openeye Name: [4-methyl-2-(1-methylpyridin-1-ium-3-carbonyl)oxy-phenyl] 1-methylpyridin-1-ium-3-carboxylate CAS Name: 1-methyl-3-pyridin-1-iumcarboxylic acid [4-methyl-2-[(1-methyl-3-pyridin-1-iumyl)-oxomethoxy]phenyl] ester IUPAC Name: [4-methyl-2-(1-methylpyridin-1-ium-3-carbonyl)oxyphenyl] 1-methylpyridin-1-ium-3-carboxylate Traditional Name: 1-methylpyridin-1-ium-3-carboxylic acid [4-methyl-2-(1-methylpyridin-1-ium-3-carbonyl)oxy-phenyl] ester Formula: C21H20N2O4+2 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=C[N+](=CC=C2)C)OC(=O)C3=C[N+](=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=C[N+](=CC=C2)C)OC(=O)C3=C[N+](=CC=C3)C

InChI

InChI=1S/C21H20N2O4/c1-15-8-9-18(26-20(24)16-6-4-10-22(2)13-16)19(12-15)27-21(25)17-7-5-11-23(3)14-17/h4-14H,1-3H3/q+2