6-(4-chlorophenyl)-2-(diethylamino)-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)-2-(diethylamino)-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Openeye Name: 6-(4-chlorophenyl)-2-(diethylamino)-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile CAS Name: 6-(4-chlorophenyl)-2-(diethylamino)-4-(trifluoromethyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 6-(4-chlorophenyl)-2-(diethylamino)-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Traditional Name: 6-(4-chlorophenyl)-2-(diethylamino)-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Formula: C17H16ClF3N3+ MolecularWeight: 354.77725

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=CC(=[NH+]1)C2=CC=C(C=C2)Cl)C(F)(F)F)C#N

Isomeric SMILES

CCN(CC)C1=C(C(=CC(=[NH+]1)C2=CC=C(C=C2)Cl)C(F)(F)F)C#N

InChI

InChI=1S/C17H15ClF3N3/c1-3-24(4-2)16-13(10-22)14(17(19,20)21)9-15(23-16)11-5-7-12(18)8-6-11/h5-9H,3-4H2,1-2H3/p+1