ethyl 6-chloranyl-2-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-2-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-chloro-2-(methylthio)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-chloro-4-keto-2-(methylthio)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1=O)C=C(C=C2)Cl)SC

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1=O)C=C(C=C2)Cl)SC

InChI

InChI=1S/C13H12ClNO3S/c1-3-18-13(17)10-11(16)8-6-7(14)4-5-9(8)15-12(10)19-2/h4-6H,3H2,1-2H3,(H,15,16)