3-[1-(dimethylamino)-1-oxidanylidene-propan-2-yl]sulfonyl-4-fluoranyl-benzoic acid

Systemtic Name: 3-[1-(dimethylamino)-1-oxidanylidene-propan-2-yl]sulfonyl-4-fluoranyl-benzoic acid Openeye Name: 3-[2-(dimethylamino)-1-methyl-2-oxo-ethyl]sulfonyl-4-fluoro-benzoic acid CAS Name: 3-[1-(dimethylamino)-1-oxopropan-2-yl]sulfonyl-4-fluorobenzoic acid IUPAC Name: 3-[1-(dimethylamino)-1-oxopropan-2-yl]sulfonyl-4-fluorobenzoic acid Traditional Name: 3-[2-(dimethylamino)-2-keto-1-methyl-ethyl]sulfonyl-4-fluoro-benzoic acid Formula: C12H14FNO5S MolecularWeight: 303.306663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)O)F

Isomeric SMILES

CC(C(=O)N(C)C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)O)F

InChI

InChI=1S/C12H14FNO5S/c1-7(11(15)14(2)3)20(18,19)10-6-8(12(16)17)4-5-9(10)13/h4-7H,1-3H3,(H,16,17)