2-[(E)-2-[1,1-dimethyl-3-(trifluoromethylsulfonyloxy)inden-5-yl]ethenyl]benzoate

Systemtic Name: 2-[(E)-2-[1,1-dimethyl-3-(trifluoromethylsulfonyloxy)inden-5-yl]ethenyl]benzoate Openeye Name: 2-[(E)-2-[1,1-dimethyl-3-(trifluoromethylsulfonyloxy)inden-5-yl]vinyl]benzoate CAS Name: 2-[(E)-2-[1,1-dimethyl-3-(trifluoromethylsulfonyloxy)-5-indenyl]ethenyl]benzoate IUPAC Name: 2-[(E)-2-[1,1-dimethyl-3-(trifluoromethylsulfonyloxy)inden-5-yl]ethenyl]benzoate Traditional Name: 2-[(E)-2-(1,1-dimethyl-3-triflyloxy-inden-5-yl)vinyl]benzoate Formula: C21H16F3O5S- MolecularWeight: 437.40895

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C1C=CC(=C2)C=CC3=CC=CC=C3C(=O)[O-])OS(=O)(=O)C(F)(F)F)C

Isomeric SMILES

CC1(C=C(C2=C1C=CC(=C2)/C=C/C3=CC=CC=C3C(=O)[O-])OS(=O)(=O)C(F)(F)F)C

InChI

InChI=1S/C21H17F3O5S/c1-20(2)12-18(29-30(27,28)21(22,23)24)16-11-13(8-10-17(16)20)7-9-14-5-3-4-6-15(14)19(25)26/h3-12H,1-2H3,(H,25,26)/p-1/b9-7+