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

Systemtic Name: methyl 1-tert-butyl-4-[pentakis(fluoranyl)-$l^{6}-sulfanyl]-3-phenyl-pyrrole-2-carboxylate Openeye Name: methyl 1-tert-butyl-4-(pentafluoro-$l^{6}-sulfanyl)-3-phenyl-pyrrole-2-carboxylate CAS Name: 1-tert-butyl-4-(pentafluoro-$l^{6}-sulfanyl)-3-phenyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-tert-butyl-4-(pentafluoro-$l^{6}-sulfanyl)-3-phenylpyrrole-2-carboxylate Traditional Name: 1-tert-butyl-4-pentafluoropersulfuranyl-3-phenyl-pyrrole-2-carboxylic acid methyl ester Formula: C16H18F5NO2S MolecularWeight: 383.376636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=C1C(=O)OC)C2=CC=CC=C2)S(F)(F)(F)(F)F

Isomeric SMILES

CC(C)(C)N1C=C(C(=C1C(=O)OC)C2=CC=CC=C2)S(F)(F)(F)(F)F

InChI

InChI=1S/C16H18F5NO2S/c1-16(2,3)22-10-12(25(17,18,19,20)21)13(14(22)15(23)24-4)11-8-6-5-7-9-11/h5-10H,1-4H3