4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-5-(3,4-dimethoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-5-(3,4-dimethoxyphenyl)pyridine-3-carbonitrile Openeye Name: 4-(3-chloro-4-fluoro-anilino)-5-(3,4-dimethoxyphenyl)pyridine-3-carbonitrile CAS Name: 4-(3-chloro-4-fluoroanilino)-5-(3,4-dimethoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 4-(3-chloro-4-fluoroanilino)-5-(3,4-dimethoxyphenyl)pyridine-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)-5-(3,4-dimethoxyphenyl)nicotinonitrile Formula: C20H15ClFN3O2 MolecularWeight: 383.803403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=CN=C2)C#N)NC3=CC(=C(C=C3)F)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=CN=C2)C#N)NC3=CC(=C(C=C3)F)Cl)OC

InChI

InChI=1S/C20H15ClFN3O2/c1-26-18-6-3-12(7-19(18)27-2)15-11-24-10-13(9-23)20(15)25-14-4-5-17(22)16(21)8-14/h3-8,10-11H,1-2H3,(H,24,25)