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2-methyl-2-[4-[3-(4-methylsulfonyloxyphenyl)propoxy]phenoxy]butanoic acid
2-methyl-2-[4-[3-(4-methylsulfonyloxyphenyl)propoxy]phenoxy]butanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCC(C)(C(=O)O)OC1=CC=C(C=C1)OCCCC2=CC=C(C=C2)OS(=O)(=O)C
Isomeric SMILES
CCC(C)(C(=O)O)OC1=CC=C(C=C1)OCCCC2=CC=C(C=C2)OS(=O)(=O)C
InChI
InChI=1S/C21H26O7S/c1-4-21(2,20(22)23)27-18-13-11-17(12-14-18)26-15-5-6-16-7-9-19(10-8-16)28-29(3,24)25/h7-14H,4-6,15H2,1-3H3,(H,22,23)
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