methyl 4-[2-azanyl-3-cyano-6-(3-fluorophenyl)pyridin-4-yl]benzoate

Systemtic Name: methyl 4-[2-azanyl-3-cyano-6-(3-fluorophenyl)pyridin-4-yl]benzoate Openeye Name: methyl 4-[2-amino-3-cyano-6-(3-fluorophenyl)-4-pyridyl]benzoate CAS Name: 4-[2-amino-3-cyano-6-(3-fluorophenyl)-4-pyridinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-amino-3-cyano-6-(3-fluorophenyl)pyridin-4-yl]benzoate Traditional Name: 4-[2-amino-3-cyano-6-(3-fluorophenyl)-4-pyridyl]benzoic acid methyl ester Formula: C20H14FN3O2 MolecularWeight: 347.342463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H14FN3O2/c1-26-20(25)13-7-5-12(6-8-13)16-10-18(24-19(23)17(16)11-22)14-3-2-4-15(21)9-14/h2-10H,1H3,(H2,23,24)