ethyl 7-chloranyl-6-fluoranyl-4-oxidanylidene-2-(2-oxidanylidenecyclohexyl)sulfanyl-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 7-chloranyl-6-fluoranyl-4-oxidanylidene-2-(2-oxidanylidenecyclohexyl)sulfanyl-1H-quinoline-3-carboxylate Openeye Name: ethyl 7-chloro-6-fluoro-4-oxo-2-(2-oxocyclohexyl)sulfanyl-1H-quinoline-3-carboxylate CAS Name: 7-chloro-6-fluoro-4-oxo-2-[(2-oxocyclohexyl)thio]-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-6-fluoro-4-oxo-2-(2-oxocyclohexyl)sulfanyl-1H-quinoline-3-carboxylate Traditional Name: 7-chloro-6-fluoro-4-keto-2-[(2-ketocyclohexyl)thio]-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H17ClFNO4S MolecularWeight: 397.848283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)Cl)SC3CCCCC3=O

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)Cl)SC3CCCCC3=O

InChI

InChI=1S/C18H17ClFNO4S/c1-2-25-18(24)15-16(23)9-7-11(20)10(19)8-12(9)21-17(15)26-14-6-4-3-5-13(14)22/h7-8,14H,2-6H2,1H3,(H,21,23)