3-fluoranyl-4-methyl-5-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid Openeye Name: 3-fluoro-4-methyl-5-[2-(methylamino)-2-oxo-ethyl]sulfonyl-benzoic acid CAS Name: 3-fluoro-4-methyl-5-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid IUPAC Name: 3-fluoro-4-methyl-5-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid Traditional Name: 3-fluoro-5-[2-keto-2-(methylamino)ethyl]sulfonyl-4-methyl-benzoic acid Formula: C11H12FNO5S MolecularWeight: 289.280083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)CC(=O)NC)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)CC(=O)NC)C(=O)O)F

InChI

InChI=1S/C11H12FNO5S/c1-6-8(12)3-7(11(15)16)4-9(6)19(17,18)5-10(14)13-2/h3-4H,5H2,1-2H3,(H,13,14)(H,15,16)