(2-bromanyl-4-methyl-phenyl) 3-fluoranylbenzenesulfonate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 3-fluoranylbenzenesulfonate Openeye Name: (2-bromo-4-methyl-phenyl) 3-fluorobenzenesulfonate CAS Name: 3-fluorobenzenesulfonic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 3-fluorobenzenesulfonate Traditional Name: 3-fluorobenzenesulfonic acid (2-bromo-4-methyl-phenyl) ester Formula: C13H10BrFO3S MolecularWeight: 345.184103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrFO3S/c1-9-5-6-13(12(14)7-9)18-19(16,17)11-4-2-3-10(15)8-11/h2-8H,1H3