6-(4-bromanylbutoxy)-2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophene 1,1-dioxide

Systemtic Name: 6-(4-bromanylbutoxy)-2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophene 1,1-dioxide Openeye Name: 6-(4-bromobutoxy)-2-methyl-3-[4-(trifluoromethyl)phenyl]benzothiophene 1,1-dioxide CAS Name: 6-(4-bromobutoxy)-2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophene 1,1-dioxide IUPAC Name: 6-(4-bromobutoxy)-2-methyl-3-[4-(trifluoromethyl)phenyl]-1-benzothiophene 1,1-dioxide Traditional Name: 6-(4-bromobutoxy)-2-methyl-3-[4-(trifluoromethyl)phenyl]benzothiophene 1,1-dioxide Formula: C20H18BrF3O3S MolecularWeight: 475.31933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1(=O)=O)C=C(C=C2)OCCCCBr)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C2=C(S1(=O)=O)C=C(C=C2)OCCCCBr)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H18BrF3O3S/c1-13-19(14-4-6-15(7-5-14)20(22,23)24)17-9-8-16(27-11-3-2-10-21)12-18(17)28(13,25)26/h4-9,12H,2-3,10-11H2,1H3