ethyl 2-(tert-butylsulfanylmethyl)-4,5,6,7-tetrakis(fluoranyl)-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-(tert-butylsulfanylmethyl)-4,5,6,7-tetrakis(fluoranyl)-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-(tert-butylsulfanylmethyl)-4,5,6,7-tetrafluoro-benzofuran-3-carboxylate CAS Name: 2-[(tert-butylthio)methyl]-4,5,6,7-tetrafluoro-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-(tert-butylsulfanylmethyl)-4,5,6,7-tetrafluoro-1-benzofuran-3-carboxylate Traditional Name: 2-[(tert-butylthio)methyl]-4,5,6,7-tetrafluoro-benzofuran-3-carboxylic acid ethyl ester Formula: C16H16F4O3S MolecularWeight: 364.355053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C(=C2F)F)F)F)CSC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C(=C2F)F)F)F)CSC(C)(C)C

InChI

InChI=1S/C16H16F4O3S/c1-5-22-15(21)8-7(6-24-16(2,3)4)23-14-9(8)10(17)11(18)12(19)13(14)20/h5-6H2,1-4H3