4-[4-(trifluoromethylsulfanyl)phenyl]-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-[4-(trifluoromethylsulfanyl)phenyl]-1H-pyrrole-3-carboxylic acid Openeye Name: 4-[4-(trifluoromethylsulfanyl)phenyl]-1H-pyrrole-3-carboxylic acid CAS Name: 4-[4-(trifluoromethylthio)phenyl]-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-[4-(trifluoromethylsulfanyl)phenyl]-1H-pyrrole-3-carboxylic acid Traditional Name: 4-[4-(trifluoromethylthio)phenyl]-1H-pyrrole-3-carboxylic acid Formula: C12H8F3NO2S MolecularWeight: 287.25763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CNC=C2C(=O)O)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=CNC=C2C(=O)O)SC(F)(F)F

InChI

InChI=1S/C12H8F3NO2S/c13-12(14,15)19-8-3-1-7(2-4-8)9-5-16-6-10(9)11(17)18/h1-6,16H,(H,17,18)