2-azanyl-6-(2,5-dimethoxyphenyl)-4-(4-fluorophenyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-6-(2,5-dimethoxyphenyl)-4-(4-fluorophenyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-6-(2,5-dimethoxyphenyl)-4-(4-fluorophenyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-6-(2,5-dimethoxyphenyl)-4-(4-fluorophenyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-6-(2,5-dimethoxyphenyl)-4-(4-fluorophenyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-6-(2,5-dimethoxyphenyl)-4-(4-fluorophenyl)pyridin-1-ium-3-carbonitrile Formula: C20H17FN3O2+ MolecularWeight: 350.366283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=[NH+]C(=C(C(=C2)C3=CC=C(C=C3)F)C#N)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=[NH+]C(=C(C(=C2)C3=CC=C(C=C3)F)C#N)N

InChI

InChI=1S/C20H16FN3O2/c1-25-14-7-8-19(26-2)16(9-14)18-10-15(17(11-22)20(23)24-18)12-3-5-13(21)6-4-12/h3-10H,1-2H3,(H2,23,24)/p+1