ethyl 7-chloranyl-2-[5-ethoxy-2,5-bis(oxidanylidene)pentyl]sulfanyl-6-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 7-chloranyl-2-[5-ethoxy-2,5-bis(oxidanylidene)pentyl]sulfanyl-6-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 7-chloro-2-(5-ethoxy-2,5-dioxo-pentyl)sulfanyl-6-fluoro-4-oxo-1H-quinoline-3-carboxylate CAS Name: 7-chloro-2-[(5-ethoxy-2,5-dioxopentyl)thio]-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-2-(5-ethoxy-2,5-dioxopentyl)sulfanyl-6-fluoro-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 7-chloro-2-[(5-ethoxy-2,5-diketo-pentyl)thio]-6-fluoro-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C19H19ClFNO6S MolecularWeight: 443.873663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)CSC1=C(C(=O)C2=CC(=C(C=C2N1)Cl)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCC(=O)CSC1=C(C(=O)C2=CC(=C(C=C2N1)Cl)F)C(=O)OCC

InChI

InChI=1S/C19H19ClFNO6S/c1-3-27-15(24)6-5-10(23)9-29-18-16(19(26)28-4-2)17(25)11-7-13(21)12(20)8-14(11)22-18/h7-8H,3-6,9H2,1-2H3,(H,22,25)