4-[(E)-2-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]ethenyl]benzoate

Systemtic Name: 4-[(E)-2-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]ethenyl]benzoate Openeye Name: 4-[(E)-2-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]vinyl]benzoate CAS Name: 4-[(E)-2-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]ethenyl]benzoate IUPAC Name: 4-[(E)-2-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]ethenyl]benzoate Traditional Name: 4-[(E)-2-(5,5-dimethyl-8-triflyloxy-6H-naphthalen-2-yl)vinyl]benzoate Formula: C22H18F3O5S- MolecularWeight: 451.43553

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=CC(=C2)C=CC3=CC=C(C=C3)C(=O)[O-])OS(=O)(=O)C(F)(F)F)C

Isomeric SMILES

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

InChI

InChI=1S/C22H19F3O5S/c1-21(2)12-11-19(30-31(28,29)22(23,24)25)17-13-15(7-10-18(17)21)4-3-14-5-8-16(9-6-14)20(26)27/h3-11,13H,12H2,1-2H3,(H,26,27)/p-1/b4-3+