3-(azetidin-1-ylsulfonyl)-5-fluoranyl-4-methyl-benzoic acid

Systemtic Name: 3-(azetidin-1-ylsulfonyl)-5-fluoranyl-4-methyl-benzoic acid Openeye Name: 3-(azetidin-1-ylsulfonyl)-5-fluoro-4-methyl-benzoic acid CAS Name: 3-(1-azetidinylsulfonyl)-5-fluoro-4-methylbenzoic acid IUPAC Name: 3-(azetidin-1-ylsulfonyl)-5-fluoro-4-methylbenzoic acid Traditional Name: 3-(azetidin-1-ylsulfonyl)-5-fluoro-4-methyl-benzoic acid Formula: C11H12FNO4S MolecularWeight: 273.280683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)N2CCC2)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)N2CCC2)C(=O)O)F

InChI

InChI=1S/C11H12FNO4S/c1-7-9(12)5-8(11(14)15)6-10(7)18(16,17)13-3-2-4-13/h5-6H,2-4H2,1H3,(H,14,15)