3,3-bis(4-fluorophenyl)propyl 4-methylbenzenesulfonate

Systemtic Name: 3,3-bis(4-fluorophenyl)propyl 4-methylbenzenesulfonate Openeye Name: 3,3-bis(4-fluorophenyl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3,3-bis(4-fluorophenyl)propyl ester IUPAC Name: 3,3-bis(4-fluorophenyl)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3,3-bis(4-fluorophenyl)propyl ester Formula: C22H20F2O3S MolecularWeight: 402.454206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20F2O3S/c1-16-2-12-21(13-3-16)28(25,26)27-15-14-22(17-4-8-19(23)9-5-17)18-6-10-20(24)11-7-18/h2-13,22H,14-15H2,1H3