2-[(2-fluoranyl-5-methylsulfonyl-phenyl)sulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(2-fluoranyl-5-methylsulfonyl-phenyl)sulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(2-fluoro-5-methylsulfonyl-phenyl)sulfonyl-methyl-amino]acetic acid CAS Name: 2-[(2-fluoro-5-methylsulfonylphenyl)sulfonyl-methylamino]acetic acid IUPAC Name: 2-[(2-fluoro-5-methylsulfonylphenyl)sulfonyl-methylamino]acetic acid Traditional Name: 2-[(2-fluoro-5-mesyl-phenyl)sulfonyl-methyl-amino]acetic acid Formula: C10H12FNO6S2 MolecularWeight: 325.333783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12FNO6S2/c1-12(6-10(13)14)20(17,18)9-5-7(19(2,15)16)3-4-8(9)11/h3-5H,6H2,1-2H3,(H,13,14)