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

Systemtic Name: 6-phenyl-2-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Openeye Name: 6-phenyl-2-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile CAS Name: 6-phenyl-2-(1-pyrrolidinyl)-4-(trifluoromethyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 6-phenyl-2-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Traditional Name: 6-phenyl-2-pyrrolidino-4-(trifluoromethyl)pyridin-1-ium-3-carbonitrile Formula: C17H15F3N3+ MolecularWeight: 318.31631

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=CC(=[NH+]2)C3=CC=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

C1CCN(C1)C2=C(C(=CC(=[NH+]2)C3=CC=CC=C3)C(F)(F)F)C#N

InChI

InChI=1S/C17H14F3N3/c18-17(19,20)14-10-15(12-6-2-1-3-7-12)22-16(13(14)11-21)23-8-4-5-9-23/h1-3,6-7,10H,4-5,8-9H2/p+1