2-(2,5-dimethylthiophen-3-yl)-6,8-bis(fluoranyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(2,5-dimethylthiophen-3-yl)-6,8-bis(fluoranyl)quinoline-4-carboxylic acid Openeye Name: 2-(2,5-dimethyl-3-thienyl)-6,8-difluoro-quinoline-4-carboxylic acid CAS Name: 2-(2,5-dimethyl-3-thiophenyl)-6,8-difluoro-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-dimethylthiophen-3-yl)-6,8-difluoroquinoline-4-carboxylic acid Traditional Name: 2-(2,5-dimethyl-3-thienyl)-6,8-difluoro-cinchoninic acid Formula: C16H11F2NO2S MolecularWeight: 319.325846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)F)F

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)F)F

InChI

InChI=1S/C16H11F2NO2S/c1-7-3-10(8(2)22-7)14-6-12(16(20)21)11-4-9(17)5-13(18)15(11)19-14/h3-6H,1-2H3,(H,20,21)