3-fluoranyl-4-propylsulfonyl-benzoic acid

Systemtic Name: 3-fluoranyl-4-propylsulfonyl-benzoic acid Openeye Name: 3-fluoro-4-propylsulfonyl-benzoic acid CAS Name: 3-fluoro-4-propylsulfonylbenzoic acid IUPAC Name: 3-fluoro-4-propylsulfonylbenzoic acid Traditional Name: 3-fluoro-4-propylsulfonyl-benzoic acid Formula: C10H11FO4S MolecularWeight: 246.255343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11FO4S/c1-2-5-16(14,15)9-4-3-7(10(12)13)6-8(9)11/h3-4,6H,2,5H2,1H3,(H,12,13)