methyl 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrole-2-carboxylate

Systemtic Name: methyl 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrole-2-carboxylate Openeye Name: methyl 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrole-2-carboxylate CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrole-2-carboxylate Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrole-2-carboxylic acid methyl ester Formula: C14H9F6NO4S MolecularWeight: 401.280979

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CN1S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=CN1S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C14H9F6NO4S/c1-25-12(22)11-3-2-4-21(11)26(23,24)10-6-8(13(15,16)17)5-9(7-10)14(18,19)20/h2-7H,1H3