methyl 4-[pentakis(fluoranyl)-$l^{6}-sulfanyl]-3-phenethyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[pentakis(fluoranyl)-$l^{6}-sulfanyl]-3-phenethyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-(pentafluoro-$l^{6}-sulfanyl)-3-phenethyl-1H-pyrrole-2-carboxylate CAS Name: 4-(pentafluoro-$l^{6}-sulfanyl)-3-phenethyl-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(pentafluoro-$l^{6}-sulfanyl)-3-phenethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-pentafluoropersulfuranyl-3-phenethyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C14H14F5NO2S MolecularWeight: 355.323476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CN1)S(F)(F)(F)(F)F)CCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C(=CN1)S(F)(F)(F)(F)F)CCC2=CC=CC=C2

InChI

InChI=1S/C14H14F5NO2S/c1-22-14(21)13-11(8-7-10-5-3-2-4-6-10)12(9-20-13)23(15,16,17,18)19/h2-6,9,20H,7-8H2,1H3