methyl 6-methyl-6-(naphthalen-2-ylmethyl)-5-(trifluoromethylsulfonyloxy)cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: methyl 6-methyl-6-(naphthalen-2-ylmethyl)-5-(trifluoromethylsulfonyloxy)cyclohexa-1,4-diene-1-carboxylate Openeye Name: methyl 6-methyl-6-(2-naphthylmethyl)-5-(trifluoromethylsulfonyloxy)cyclohexa-1,4-diene-1-carboxylate CAS Name: 6-methyl-6-(2-naphthalenylmethyl)-5-(trifluoromethylsulfonyloxy)-1-cyclohexa-1,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 6-methyl-6-(naphthalen-2-ylmethyl)-5-(trifluoromethylsulfonyloxy)cyclohexa-1,4-diene-1-carboxylate Traditional Name: 6-methyl-6-(2-naphthylmethyl)-5-triflyloxy-cyclohexa-1,4-diene-1-carboxylic acid methyl ester Formula: C21H19F3O5S MolecularWeight: 440.43277

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CCC=C1OS(=O)(=O)C(F)(F)F)C(=O)OC)CC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1(C(=CCC=C1OS(=O)(=O)C(F)(F)F)C(=O)OC)CC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H19F3O5S/c1-20(13-14-10-11-15-6-3-4-7-16(15)12-14)17(19(25)28-2)8-5-9-18(20)29-30(26,27)21(22,23)24/h3-4,6-12H,5,13H2,1-2H3