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4,4-bis(4-fluorophenyl)butyl 3-(methylsulfonylmethyl)benzoate

4,4-bis(4-fluorophenyl)butyl 3-(methylsulfonylmethyl)benzoate

Systemtic Name:4,4-bis(4-fluorophenyl)butyl 3-(methylsulfonylmethyl)benzoate
Openeye Name:4,4-bis(4-fluorophenyl)butyl 3-(methylsulfonylmethyl)benzoate
CAS Name:3-(methylsulfonylmethyl)benzoic acid 4,4-bis(4-fluorophenyl)butyl ester
IUPAC Name:4,4-bis(4-fluorophenyl)butyl 3-(methylsulfonylmethyl)benzoate
Traditional Name:3-(mesylmethyl)benzoic acid 4,4-bis(4-fluorophenyl)butyl ester
Formula: C25H24F2O4S
MolecularWeight: 458.517466
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OCCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F


Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OCCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F


InChI

InChI=1S/C25H24F2O4S/c1-32(29,30)17-18-4-2-5-21(16-18)25(28)31-15-3-6-24(19-7-11-22(26)12-8-19)20-9-13-23(27)14-10-20/h2,4-5,7-14,16,24H,3,6,15,17H2,1H3


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