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

Systemtic Name: 6-phenyl-2-(prop-2-enylamino)-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-(allylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile CAS Name: 6-phenyl-2-(prop-2-enylamino)-4-(trifluoromethyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 6-phenyl-2-(prop-2-enylamino)-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-(allylamino)-6-phenyl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Formula: C16H13F3N3+ MolecularWeight: 304.28973

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=C(C(=CC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F)C#N

Isomeric SMILES

C=CCNC1=C(C(=CC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F)C#N

InChI

InChI=1S/C16H12F3N3/c1-2-8-21-15-12(10-20)13(16(17,18)19)9-14(22-15)11-6-4-3-5-7-11/h2-7,9H,1,8H2,(H,21,22)/p+1