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

Systemtic Name: 3-butylsulfonyl-5-fluoranyl-4-methyl-benzoic acid Openeye Name: 3-butylsulfonyl-5-fluoro-4-methyl-benzoic acid CAS Name: 3-butylsulfonyl-5-fluoro-4-methylbenzoic acid IUPAC Name: 3-butylsulfonyl-5-fluoro-4-methylbenzoic acid Traditional Name: 3-butylsulfonyl-5-fluoro-4-methyl-benzoic acid Formula: C12H15FO4S MolecularWeight: 274.308503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

InChI

InChI=1S/C12H15FO4S/c1-3-4-5-18(16,17)11-7-9(12(14)15)6-10(13)8(11)2/h6-7H,3-5H2,1-2H3,(H,14,15)