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

Systemtic Name: N-(2,6-diethylphenyl)-6-methyl-1-oxidanidyl-4-prop-2-enoxy-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide Openeye Name: 4-allyloxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-6-methyl-1-oxido-4-prop-2-enoxy-2-(trifluoromethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,6-diethylphenyl)-6-methyl-1-oxido-4-prop-2-enoxy-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide Traditional Name: 4-allyloxy-N-(2,6-diethylphenyl)-6-methyl-1-oxido-2-(trifluoromethyl)pyridin-1-ium-3-carboxamide Formula: C21H23F3N2O3 MolecularWeight: 408.41413

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C([N+](=C(C=C2OCC=C)C)[O-])C(F)(F)F

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C([N+](=C(C=C2OCC=C)C)[O-])C(F)(F)F

InChI

InChI=1S/C21H23F3N2O3/c1-5-11-29-16-12-13(4)26(28)19(21(22,23)24)17(16)20(27)25-18-14(6-2)9-8-10-15(18)7-3/h5,8-10,12H,1,6-7,11H2,2-4H3,(H,25,27)