ethyl 4-(4-chlorophenyl)-2-oxidanylidene-5-(phenylsulfonyl)-6-(trichloromethyl)-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-oxidanylidene-5-(phenylsulfonyl)-6-(trichloromethyl)-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-(benzenesulfonyl)-4-(4-chlorophenyl)-2-oxo-6-(trichloromethyl)-1H-pyridine-3-carboxylate CAS Name: 5-(benzenesulfonyl)-4-(4-chlorophenyl)-2-oxo-6-(trichloromethyl)-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(benzenesulfonyl)-4-(4-chlorophenyl)-2-oxo-6-(trichloromethyl)-1H-pyridine-3-carboxylate Traditional Name: 5-besyl-4-(4-chlorophenyl)-2-keto-6-(trichloromethyl)-1H-pyridine-3-carboxylic acid ethyl ester Formula: C21H15Cl4NO5S MolecularWeight: 535.2245

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(NC1=O)C(Cl)(Cl)Cl)S(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(NC1=O)C(Cl)(Cl)Cl)S(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H15Cl4NO5S/c1-2-31-20(28)16-15(12-8-10-13(22)11-9-12)17(18(21(23,24)25)26-19(16)27)32(29,30)14-6-4-3-5-7-14/h3-11H,2H2,1H3,(H,26,27)