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

Systemtic Name: ethyl 3-ethylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate Openeye Name: ethyl 3-ethylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate CAS Name: 3-ethylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoic acid ethyl ester IUPAC Name: ethyl 3-ethylsulfonyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate Traditional Name: 3-esyloxy-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]valeric acid ethyl ester Formula: C22H25F3O7S MolecularWeight: 490.48991

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C22H25F3O7S/c1-4-29-21(26)14-20(32-33(27,28)5-2)15(3)30-17-10-12-19(13-11-17)31-18-8-6-16(7-9-18)22(23,24)25/h6-13,15,20H,4-5,14H2,1-3H3