ethyl 4-[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-pyridin-2-yl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 4-[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-pyridin-2-yl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 4-[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-2-pyridyl]isoxazole-3-carboxylate CAS Name: 4-[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-2-pyridinyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-chlorophenyl)-3,5-dicyano-6-methylpyridin-2-yl]-1,2-oxazole-3-carboxylate Traditional Name: 4-[4-(4-chlorophenyl)-3,5-dicyano-6-methyl-2-pyridyl]isoxazole-3-carboxylic acid ethyl ester Formula: C20H13ClN4O3 MolecularWeight: 392.79522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC=C1C2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)Cl)C#N)C

Isomeric SMILES

CCOC(=O)C1=NOC=C1C2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)Cl)C#N)C

InChI

InChI=1S/C20H13ClN4O3/c1-3-27-20(26)19-16(10-28-25-19)18-15(9-23)17(14(8-22)11(2)24-18)12-4-6-13(21)7-5-12/h4-7,10H,3H2,1-2H3