ethyl 6,7,8-tris(fluoranyl)-4-(3-methoxyphenyl)sulfanyl-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7,8-tris(fluoranyl)-4-(3-methoxyphenyl)sulfanyl-quinoline-3-carboxylate Openeye Name: ethyl 6,7,8-trifluoro-4-(3-methoxyphenyl)sulfanyl-quinoline-3-carboxylate CAS Name: 6,7,8-trifluoro-4-[(3-methoxyphenyl)thio]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7,8-trifluoro-4-(3-methoxyphenyl)sulfanylquinoline-3-carboxylate Traditional Name: 6,7,8-trifluoro-4-[(3-methoxyphenyl)thio]quinoline-3-carboxylic acid ethyl ester Formula: C19H14F3NO3S MolecularWeight: 393.37957

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C(=C2N=C1)F)F)F)SC3=CC=CC(=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C(=C2N=C1)F)F)F)SC3=CC=CC(=C3)OC

InChI

InChI=1S/C19H14F3NO3S/c1-3-26-19(24)13-9-23-17-12(8-14(20)15(21)16(17)22)18(13)27-11-6-4-5-10(7-11)25-2/h4-9H,3H2,1-2H3