trifluoromethylsulfanyl 1H-pyrrole-3-carboxylate

Systemtic Name: trifluoromethylsulfanyl 1H-pyrrole-3-carboxylate Openeye Name: trifluoromethylsulfanyl 1H-pyrrole-3-carboxylate CAS Name: 1H-pyrrole-3-carboxylic acid (trifluoromethylthio) ester IUPAC Name: trifluoromethylsulfanyl 1H-pyrrole-3-carboxylate Traditional Name: 1H-pyrrole-3-carboxylic acid (trifluoromethylthio) ester Formula: C6H4F3NO2S MolecularWeight: 211.16167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC=C1C(=O)OSC(F)(F)F

Isomeric SMILES

C1=CNC=C1C(=O)OSC(F)(F)F

InChI

InChI=1S/C6H4F3NO2S/c7-6(8,9)13-12-5(11)4-1-2-10-3-4/h1-3,10H