2-[4-(4-fluoranylphenoxy)phenoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[4-(4-fluoranylphenoxy)phenoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[4-(4-fluorophenoxy)phenoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[4-(4-fluorophenoxy)phenoxy]ethyl ester IUPAC Name: 2-[4-(4-fluorophenoxy)phenoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[4-(4-fluorophenoxy)phenoxy]ethyl ester Formula: C21H19FO5S MolecularWeight: 402.435963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)OC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FO5S/c1-16-2-12-21(13-3-16)28(23,24)26-15-14-25-18-8-10-20(11-9-18)27-19-6-4-17(22)5-7-19/h2-13H,14-15H2,1H3