2-(butylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 2-(butylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carboxamide Openeye Name: 2-(butylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carboxamide CAS Name: 2-(butylamino)-6-phenyl-4-(trifluoromethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 2-(butylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carboxamide Traditional Name: 2-(butylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carboxamide Formula: C17H19F3N3O+ MolecularWeight: 338.34747

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=CC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F)C(=O)N

Isomeric SMILES

CCCCNC1=C(C(=CC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F)C(=O)N

InChI

InChI=1S/C17H18F3N3O/c1-2-3-9-22-16-14(15(21)24)12(17(18,19)20)10-13(23-16)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3,(H2,21,24)(H,22,23)/p+1