2-(1-fluoroethyl)-4-methyl-benzenesulfonic acid

Systemtic Name: 2-(1-fluoroethyl)-4-methyl-benzenesulfonic acid Openeye Name: 2-(1-fluoroethyl)-4-methyl-benzenesulfonic acid CAS Name: 2-(1-fluoroethyl)-4-methylbenzenesulfonic acid IUPAC Name: 2-(1-fluoroethyl)-4-methylbenzenesulfonic acid Traditional Name: 2-(1-fluoroethyl)-4-methyl-besylic acid Formula: C9H11FO3S MolecularWeight: 218.245243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)C(C)F

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)C(C)F

InChI

InChI=1S/C9H11FO3S/c1-6-3-4-9(14(11,12)13)8(5-6)7(2)10/h3-5,7H,1-2H3,(H,11,12,13)