ethyl 6-fluoranyl-7-(2-methyl-1,3-dithian-2-yl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-fluoranyl-7-(2-methyl-1,3-dithian-2-yl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-fluoro-7-(2-methyl-1,3-dithian-2-yl)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-fluoro-7-(2-methyl-1,3-dithian-2-yl)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-fluoro-7-(2-methyl-1,3-dithian-2-yl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-fluoro-4-keto-7-(2-methyl-1,3-dithian-2-yl)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C17H18FNO3S2 MolecularWeight: 367.458123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=CC(=C(C=C2C1=O)F)C3(SCCCS3)C

Isomeric SMILES

CCOC(=O)C1=CNC2=CC(=C(C=C2C1=O)F)C3(SCCCS3)C

InChI

InChI=1S/C17H18FNO3S2/c1-3-22-16(21)11-9-19-14-8-12(13(18)7-10(14)15(11)20)17(2)23-5-4-6-24-17/h7-9H,3-6H2,1-2H3,(H,19,20)