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

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

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14FNO5S/c1-3-14-11(15)7(2)20(18,19)10-6-8(12(16)17)4-5-9(10)13/h4-7H,3H2,1-2H3,(H,14,15)(H,16,17)