O5-ethyl O3-methyl 4-(2-chlorophenyl)-2-methyl-6-(pyridin-1-ium-1-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-methyl 4-(2-chlorophenyl)-2-methyl-6-(pyridin-1-ium-1-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-methyl 4-(2-chlorophenyl)-2-methyl-6-(pyridin-1-ium-1-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-chlorophenyl)-2-methyl-6-(1-pyridin-1-iumylmethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester IUPAC Name: 5-O-ethyl 3-O-methyl 4-(2-chlorophenyl)-2-methyl-6-(pyridin-1-ium-1-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-chlorophenyl)-2-methyl-6-(pyridin-1-ium-1-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester Formula: C23H24ClN2O4+ MolecularWeight: 427.90066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)C[N+]3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)C[N+]3=CC=CC=C3

InChI

InChI=1S/C23H23ClN2O4/c1-4-30-23(28)21-18(14-26-12-8-5-9-13-26)25-15(2)19(22(27)29-3)20(21)16-10-6-7-11-17(16)24/h5-13,20H,4,14H2,1-3H3/p+1