3-chloranylsulfonyl-5-fluoranyl-4-methyl-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-5-fluoranyl-4-methyl-benzoic acid Openeye Name: 3-chlorosulfonyl-5-fluoro-4-methyl-benzoic acid CAS Name: 3-chlorosulfonyl-5-fluoro-4-methylbenzoic acid IUPAC Name: 3-chlorosulfonyl-5-fluoro-4-methylbenzoic acid Traditional Name: 3-chlorosulfonyl-5-fluoro-4-methyl-benzoic acid Formula: C8H6ClFO4S MolecularWeight: 252.647243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)Cl)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)Cl)C(=O)O)F

InChI

InChI=1S/C8H6ClFO4S/c1-4-6(10)2-5(8(11)12)3-7(4)15(9,13)14/h2-3H,1H3,(H,11,12)