2-(2-chlorophenyl)-N-(2,6-diethylphenyl)-6-methyl-1-oxidanidyl-4-propoxy-pyridin-1-ium-3-carboxamide

Systemtic Name: 2-(2-chlorophenyl)-N-(2,6-diethylphenyl)-6-methyl-1-oxidanidyl-4-propoxy-pyridin-1-ium-3-carboxamide Openeye Name: 2-(2-chlorophenyl)-N-(2,6-diethylphenyl)-6-methyl-1-oxido-4-propoxy-pyridin-1-ium-3-carboxamide CAS Name: 2-(2-chlorophenyl)-N-(2,6-diethylphenyl)-6-methyl-1-oxido-4-propoxy-3-pyridin-1-iumcarboxamide IUPAC Name: 2-(2-chlorophenyl)-N-(2,6-diethylphenyl)-6-methyl-1-oxido-4-propoxypyridin-1-ium-3-carboxamide Traditional Name: 2-(2-chlorophenyl)-N-(2,6-diethylphenyl)-6-methyl-1-oxido-4-propoxy-pyridin-1-ium-3-carboxamide Formula: C26H29ClN2O3 MolecularWeight: 452.97306

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=CC=C2CC)CC)C3=CC=CC=C3Cl)[O-])C

Isomeric SMILES

CCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=CC=C2CC)CC)C3=CC=CC=C3Cl)[O-])C

InChI

InChI=1S/C26H29ClN2O3/c1-5-15-32-22-16-17(4)29(31)25(20-13-8-9-14-21(20)27)23(22)26(30)28-24-18(6-2)11-10-12-19(24)7-3/h8-14,16H,5-7,15H2,1-4H3,(H,28,30)