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

Systemtic Name: ethyl 4-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]benzoate Openeye Name: ethyl 4-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]benzoate CAS Name: 4-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5,5-dimethyl-8-(trifluoromethylsulfonyloxy)-6H-naphthalen-2-yl]benzoate Traditional Name: 4-(5,5-dimethyl-8-triflyloxy-6H-naphthalen-2-yl)benzoic acid ethyl ester Formula: C22H21F3O5S MolecularWeight: 454.45935

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)C(CC=C3OS(=O)(=O)C(F)(F)F)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)C(CC=C3OS(=O)(=O)C(F)(F)F)(C)C

InChI

InChI=1S/C22H21F3O5S/c1-4-29-20(26)15-7-5-14(6-8-15)16-9-10-18-17(13-16)19(11-12-21(18,2)3)30-31(27,28)22(23,24)25/h5-11,13H,4,12H2,1-3H3