2-[2,4-bis(fluoranyl)phenyl]sulfanylquinoline-4-carboxylic acid

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]sulfanylquinoline-4-carboxylic acid Openeye Name: 2-(2,4-difluorophenyl)sulfanylquinoline-4-carboxylic acid CAS Name: 2-[(2,4-difluorophenyl)thio]-4-quinolinecarboxylic acid IUPAC Name: 2-(2,4-difluorophenyl)sulfanylquinoline-4-carboxylic acid Traditional Name: 2-[(2,4-difluorophenyl)thio]cinchoninic acid Formula: C16H9F2NO2S MolecularWeight: 317.309966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)SC3=C(C=C(C=C3)F)F)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)SC3=C(C=C(C=C3)F)F)C(=O)O

InChI

InChI=1S/C16H9F2NO2S/c17-9-5-6-14(12(18)7-9)22-15-8-11(16(20)21)10-3-1-2-4-13(10)19-15/h1-8H,(H,20,21)