ethyl 6,7,8-tris(fluoranyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7,8-tris(fluoranyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6,7,8-trifluoro-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 6,7,8-trifluoro-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7,8-trifluoro-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 6,7,8-trifluoro-4-keto-1-(6-methyl-1,3-benzothiazol-2-yl)quinoline-3-carboxylic acid ethyl ester Formula: C20H13F3N2O3S MolecularWeight: 418.38903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)F)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)F)C3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C20H13F3N2O3S/c1-3-28-19(27)11-8-25(20-24-13-5-4-9(2)6-14(13)29-20)17-10(18(11)26)7-12(21)15(22)16(17)23/h4-8H,3H2,1-2H3