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

Systemtic Name: methyl 4-[2-azanyl-6-(4-chlorophenyl)-3-cyano-pyridin-4-yl]benzoate Openeye Name: methyl 4-[2-amino-6-(4-chlorophenyl)-3-cyano-4-pyridyl]benzoate CAS Name: 4-[2-amino-6-(4-chlorophenyl)-3-cyano-4-pyridinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-amino-6-(4-chlorophenyl)-3-cyanopyridin-4-yl]benzoate Traditional Name: 4-[2-amino-6-(4-chlorophenyl)-3-cyano-4-pyridyl]benzoic acid methyl ester Formula: C20H14ClN3O2 MolecularWeight: 363.79706

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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=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClN3O2/c1-26-20(25)14-4-2-12(3-5-14)16-10-18(24-19(23)17(16)11-22)13-6-8-15(21)9-7-13/h2-10H,1H3,(H2,23,24)