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

Systemtic Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxidanidyl-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide Openeye Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide CAS Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-(trifluoromethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide Traditional Name: 4-butoxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide Formula: C22H27F3N2O3 MolecularWeight: 424.45659

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=CC=C2CC)CC)C(F)(F)F)[O-])C

Isomeric SMILES

CCCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=CC=C2CC)CC)C(F)(F)F)[O-])C

InChI

InChI=1S/C22H27F3N2O3/c1-5-8-12-30-17-13-14(4)27(29)20(22(23,24)25)18(17)21(28)26-19-15(6-2)10-9-11-16(19)7-3/h9-11,13H,5-8,12H2,1-4H3,(H,26,28)