ethyl 3-methylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate

Systemtic Name: ethyl 3-methylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate Openeye Name: ethyl 3-methylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate CAS Name: 3-methylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoic acid ethyl ester IUPAC Name: ethyl 3-methylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate Traditional Name: 3-methylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]valeric acid ethyl ester Formula: C21H23F3O7S MolecularWeight: 476.46333

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(C)OC1=CC=C(C=C1)OC2=CC=C(C=C2)C(F)(F)F)OS(=O)(=O)C

Isomeric SMILES

CCOC(=O)CC(C(C)OC1=CC=C(C=C1)OC2=CC=C(C=C2)C(F)(F)F)OS(=O)(=O)C

InChI

InChI=1S/C21H23F3O7S/c1-4-28-20(25)13-19(31-32(3,26)27)14(2)29-16-9-11-18(12-10-16)30-17-7-5-15(6-8-17)21(22,23)24/h5-12,14,19H,4,13H2,1-3H3