ethyl 7-chloranyl-6-fluoranyl-4-oxidanyl-2-sulfanyl-1H-quinoline-2-carboxylate

Systemtic Name: ethyl 7-chloranyl-6-fluoranyl-4-oxidanyl-2-sulfanyl-1H-quinoline-2-carboxylate Openeye Name: ethyl 7-chloro-6-fluoro-4-hydroxy-2-sulfanyl-1H-quinoline-2-carboxylate CAS Name: 7-chloro-6-fluoro-4-hydroxy-2-mercapto-1H-quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-6-fluoro-4-hydroxy-2-sulfanyl-1H-quinoline-2-carboxylate Traditional Name: 7-chloro-6-fluoro-4-hydroxy-2-mercapto-1H-quinoline-2-carboxylic acid ethyl ester Formula: C12H11ClFNO3S MolecularWeight: 303.737043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=C(C2=CC(=C(C=C2N1)Cl)F)O)S

Isomeric SMILES

CCOC(=O)C1(C=C(C2=CC(=C(C=C2N1)Cl)F)O)S

InChI

InChI=1S/C12H11ClFNO3S/c1-2-18-11(17)12(19)5-10(16)6-3-8(14)7(13)4-9(6)15-12/h3-5,15-16,19H,2H2,1H3