methyl 4-chloranyl-3-[[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]amino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]amino]benzoate Openeye Name: methyl 4-chloro-3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]amino]benzoate CAS Name: 4-chloro-3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]amino]benzoate Traditional Name: 4-chloro-3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]amino]benzoic acid methyl ester Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)NC3=C(C=CC(=C3)C(=O)OC)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)NC3=C(C=CC(=C3)C(=O)OC)Cl

InChI

InChI=1S/C21H16ClN3O3/c1-27-16-7-3-13(4-8-16)18-10-6-15(12-23)20(24-18)25-19-11-14(21(26)28-2)5-9-17(19)22/h3-11H,1-2H3,(H,24,25)