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

Systemtic Name: methyl 4-[2-azanyl-3-cyano-6-(4-cyanophenyl)pyridin-4-yl]benzoate Openeye Name: methyl 4-[2-amino-3-cyano-6-(4-cyanophenyl)-4-pyridyl]benzoate CAS Name: 4-[2-amino-3-cyano-6-(4-cyanophenyl)-4-pyridinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-amino-3-cyano-6-(4-cyanophenyl)pyridin-4-yl]benzoate Traditional Name: 4-[2-amino-3-cyano-6-(4-cyanophenyl)-4-pyridyl]benzoic acid methyl ester Formula: C21H14N4O2 MolecularWeight: 354.36146

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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)C#N

Isomeric SMILES

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

InChI

InChI=1S/C21H14N4O2/c1-27-21(26)16-8-6-14(7-9-16)17-10-19(25-20(24)18(17)12-23)15-4-2-13(11-22)3-5-15/h2-10H,1H3,(H2,24,25)