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

Systemtic Name: 3-fluoranyl-4-methyl-5-propylsulfonyl-benzoic acid Openeye Name: 3-fluoro-4-methyl-5-propylsulfonyl-benzoic acid CAS Name: 3-fluoro-4-methyl-5-propylsulfonylbenzoic acid IUPAC Name: 3-fluoro-4-methyl-5-propylsulfonylbenzoic acid Traditional Name: 3-fluoro-4-methyl-5-propylsulfonyl-benzoic acid Formula: C11H13FO4S MolecularWeight: 260.281923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13FO4S/c1-3-4-17(15,16)10-6-8(11(13)14)5-9(12)7(10)2/h5-6H,3-4H2,1-2H3,(H,13,14)