2-(3,4-dimethoxyphenyl)-6-(trifluoromethylsulfonyl)-5H-1-benzothiophen-4-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)-6-(trifluoromethylsulfonyl)-5H-1-benzothiophen-4-one Openeye Name: 2-(3,4-dimethoxyphenyl)-6-(trifluoromethylsulfonyl)-5H-benzothiophen-4-one CAS Name: 2-(3,4-dimethoxyphenyl)-6-(trifluoromethylsulfonyl)-5H-1-benzothiophen-4-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-6-(trifluoromethylsulfonyl)-5H-1-benzothiophen-4-one Traditional Name: 2-(3,4-dimethoxyphenyl)-6-triflyl-5H-benzothiophen-4-one Formula: C17H13F3O5S2 MolecularWeight: 418.40733

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=C(S2)C=C(CC3=O)S(=O)(=O)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=C(S2)C=C(CC3=O)S(=O)(=O)C(F)(F)F)OC

InChI

InChI=1S/C17H13F3O5S2/c1-24-13-4-3-9(5-14(13)25-2)15-8-11-12(21)6-10(7-16(11)26-15)27(22,23)17(18,19)20/h3-5,7-8H,6H2,1-2H3