[5-(4-methylphenyl)sulfonyloxy-1-[3-(trifluoromethyl)phenoxy]pentan-2-yl] ethanoate

Systemtic Name: [5-(4-methylphenyl)sulfonyloxy-1-[3-(trifluoromethyl)phenoxy]pentan-2-yl] ethanoate Openeye Name: [4-(p-tolylsulfonyloxy)-1-[[3-(trifluoromethyl)phenoxy]methyl]butyl] acetate CAS Name: acetic acid [5-(4-methylphenyl)sulfonyloxy-1-[3-(trifluoromethyl)phenoxy]pentan-2-yl] ester IUPAC Name: [5-(4-methylphenyl)sulfonyloxy-1-[3-(trifluoromethyl)phenoxy]pentan-2-yl] acetate Traditional Name: acetic acid [4-tosyloxy-1-[[3-(trifluoromethyl)phenoxy]methyl]butyl] ester Formula: C21H23F3O6S MolecularWeight: 460.46393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(COC2=CC=CC(=C2)C(F)(F)F)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(COC2=CC=CC(=C2)C(F)(F)F)OC(=O)C

InChI

InChI=1S/C21H23F3O6S/c1-15-8-10-20(11-9-15)31(26,27)29-12-4-7-19(30-16(2)25)14-28-18-6-3-5-17(13-18)21(22,23)24/h3,5-6,8-11,13,19H,4,7,12,14H2,1-2H3