5-chloranylsulfonyl-2-fluoranyl-4-methyl-benzoic acid

Systemtic Name: 5-chloranylsulfonyl-2-fluoranyl-4-methyl-benzoic acid Openeye Name: 5-chlorosulfonyl-2-fluoro-4-methyl-benzoic acid CAS Name: 5-chlorosulfonyl-2-fluoro-4-methylbenzoic acid IUPAC Name: 5-chlorosulfonyl-2-fluoro-4-methylbenzoic acid Traditional Name: 5-chlorosulfonyl-2-fluoro-4-methyl-benzoic acid Formula: C8H6ClFO4S MolecularWeight: 252.647243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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