chloranylbenzene; ethyl 7-chloranyl-6-fluoranyl-4-sulfanylidene-1H-quinoline-3-carboxylate

Systemtic Name: chloranylbenzene; ethyl 7-chloranyl-6-fluoranyl-4-sulfanylidene-1H-quinoline-3-carboxylate Openeye Name: chlorobenzene; ethyl 7-chloro-6-fluoro-4-thioxo-1H-quinoline-3-carboxylate CAS Name: chlorobenzene; 7-chloro-6-fluoro-4-sulfanylidene-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: chlorobenzene; ethyl 7-chloro-6-fluoro-4-sulfanylidene-1H-quinoline-3-carboxylate Traditional Name: chlorobenzene; 7-chloro-6-fluoro-4-thioxo-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H14Cl2FNO2S MolecularWeight: 398.278663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=CC(=C(C=C2C1=S)F)Cl.C1=CC=C(C=C1)Cl

Isomeric SMILES

CCOC(=O)C1=CNC2=CC(=C(C=C2C1=S)F)Cl.C1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H9ClFNO2S.C6H5Cl/c1-2-17-12(16)7-5-15-10-4-8(13)9(14)3-6(10)11(7)18;7-6-4-2-1-3-5-6/h3-5H,2H2,1H3,(H,15,18);1-5H