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methyl 12-acetyloxy-8-methylsulfonyl-13-[3-(trifluoromethyl)phenoxy]tridecanoate
methyl 12-acetyloxy-8-methylsulfonyl-13-[3-(trifluoromethyl)phenoxy]tridecanoate
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)OC(CCCC(CCCCCCC(=O)OC)S(=O)(=O)C)COC1=CC=CC(=C1)C(F)(F)F
Isomeric SMILES
CC(=O)OC(CCCC(CCCCCCC(=O)OC)S(=O)(=O)C)COC1=CC=CC(=C1)C(F)(F)F
InChI
InChI=1S/C24H35F3O7S/c1-18(28)34-21(17-33-20-11-8-10-19(16-20)24(25,26)27)12-9-14-22(35(3,30)31)13-6-4-5-7-15-23(29)32-2/h8,10-11,16,21-22H,4-7,9,12-15,17H2,1-3H3
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