(2,3,5-trimethylphenyl) 4-fluoranylbenzenesulfonate

Systemtic Name: (2,3,5-trimethylphenyl) 4-fluoranylbenzenesulfonate Openeye Name: (2,3,5-trimethylphenyl) 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid (2,3,5-trimethylphenyl) ester IUPAC Name: (2,3,5-trimethylphenyl) 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid (2,3,5-trimethylphenyl) ester Formula: C15H15FO3S MolecularWeight: 294.341203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C)C

InChI

InChI=1S/C15H15FO3S/c1-10-8-11(2)12(3)15(9-10)19-20(17,18)14-6-4-13(16)5-7-14/h4-9H,1-3H3