ethyl 6,7-bis(fluoranyl)-4-(phenylcarbonyloxy)-2-sulfanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7-bis(fluoranyl)-4-(phenylcarbonyloxy)-2-sulfanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-benzoyloxy-6,7-difluoro-2-thioxo-1H-quinoline-3-carboxylate CAS Name: 4-benzoyloxy-6,7-difluoro-2-sulfanylidene-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-benzoyloxy-6,7-difluoro-2-sulfanylidene-1H-quinoline-3-carboxylate Traditional Name: 4-benzoyloxy-6,7-difluoro-2-thioxo-1H-quinoline-3-carboxylic acid ethyl ester Formula: C19H13F2NO4S MolecularWeight: 389.372626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2NC1=S)F)F)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2NC1=S)F)F)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H13F2NO4S/c1-2-25-19(24)15-16(26-18(23)10-6-4-3-5-7-10)11-8-12(20)13(21)9-14(11)22-17(15)27/h3-9H,2H2,1H3,(H,22,27)