O3-methyl O5-(1-phenyl-2-piperidin-1-yl-ethyl) 2,6-dimethyl-4-(1-oxidanidylpyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-(1-phenyl-2-piperidin-1-yl-ethyl) 2,6-dimethyl-4-(1-oxidanidylpyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-[1-phenyl-2-(1-piperidyl)ethyl] 2,6-dimethyl-4-(1-oxidopyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(1-oxido-3-pyridin-1-iumyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-[1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: 3-O-methyl 5-O-(1-phenyl-2-piperidin-1-ylethyl) 2,6-dimethyl-4-(1-oxidopyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(1-oxidopyridin-1-ium-3-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-(1-phenyl-2-piperidino-ethyl) ester Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(CN2CCCCC2)C3=CC=CC=C3)C4=C[N+](=CC=C4)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(CN2CCCCC2)C3=CC=CC=C3)C4=C[N+](=CC=C4)[O-])C(=O)OC

InChI

InChI=1S/C28H33N3O5/c1-19-24(27(32)35-3)26(22-13-10-16-31(34)17-22)25(20(2)29-19)28(33)36-23(21-11-6-4-7-12-21)18-30-14-8-5-9-15-30/h4,6-7,10-13,16-17,23,26,29H,5,8-9,14-15,18H2,1-3H3