bis(fluoranyl)methylsulfanyl 1H-pyrrole-2-carboxylate

Systemtic Name: bis(fluoranyl)methylsulfanyl 1H-pyrrole-2-carboxylate Openeye Name: difluoromethylsulfanyl 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid (difluoromethylthio) ester IUPAC Name: difluoromethylsulfanyl 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid (difluoromethylthio) ester Formula: C6H5F2NO2S MolecularWeight: 193.171206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)C(=O)OSC(F)F

Isomeric SMILES

C1=CNC(=C1)C(=O)OSC(F)F

InChI

InChI=1S/C6H5F2NO2S/c7-6(8)12-11-5(10)4-2-1-3-9-4/h1-3,6,9H