2-methylpropyl 2-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfonylphenoxy]butanoate

Systemtic Name: 2-methylpropyl 2-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfonylphenoxy]butanoate Openeye Name: isobutyl 2-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfonylphenoxy]butanoate CAS Name: 2-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfonylphenoxy]butanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfonylphenoxy]butanoate Traditional Name: 2-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfonylphenoxy]butyric acid isobutyl ester Formula: C22H25F3O5S MolecularWeight: 458.49111

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(C)C)OC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CCC(C(=O)OCC(C)C)OC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C22H25F3O5S/c1-5-19(21(26)29-13-14(2)3)30-17-7-9-18(10-8-17)31(27,28)20-11-6-16(12-15(20)4)22(23,24)25/h6-12,14,19H,5,13H2,1-4H3