2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-(2-hydroxyethylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Formula: C15H13F3N3O+ MolecularWeight: 308.27843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C(F)(F)F)C#N)NCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=[NH+]C(=C(C(=C2)C(F)(F)F)C#N)NCCO

InChI

InChI=1S/C15H12F3N3O/c16-15(17,18)12-8-13(10-4-2-1-3-5-10)21-14(11(12)9-19)20-6-7-22/h1-5,8,22H,6-7H2,(H,20,21)/p+1