4-[3,4-bis(fluoranyl)phenyl]sulfanylpyridine-2-carboxylic acid

Systemtic Name: 4-[3,4-bis(fluoranyl)phenyl]sulfanylpyridine-2-carboxylic acid Openeye Name: 4-(3,4-difluorophenyl)sulfanylpyridine-2-carboxylic acid CAS Name: 4-[(3,4-difluorophenyl)thio]-2-pyridinecarboxylic acid IUPAC Name: 4-(3,4-difluorophenyl)sulfanylpyridine-2-carboxylic acid Traditional Name: 4-[(3,4-difluorophenyl)thio]picolinic acid Formula: C12H7F2NO2S MolecularWeight: 267.251286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SC2=CC(=NC=C2)C(=O)O)F)F

Isomeric SMILES

C1=CC(=C(C=C1SC2=CC(=NC=C2)C(=O)O)F)F

InChI

InChI=1S/C12H7F2NO2S/c13-9-2-1-7(5-10(9)14)18-8-3-4-15-11(6-8)12(16)17/h1-6H,(H,16,17)