2-[(4-fluoranyl-2-nitro-phenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: 2-[(4-fluoranyl-2-nitro-phenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: 2-[(4-fluoro-2-nitro-phenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-fluoro-2-nitrophenyl)sulfonyl-methylamino]acetate IUPAC Name: 2-[(4-fluoro-2-nitrophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-fluoro-2-nitro-phenyl)sulfonyl-methyl-amino]acetate Formula: C9H8FN2O6S- MolecularWeight: 291.233023

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)[O-])S(=O)(=O)C1=C(C=C(C=C1)F)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)[O-])S(=O)(=O)C1=C(C=C(C=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C9H9FN2O6S/c1-11(5-9(13)14)19(17,18)8-3-2-6(10)4-7(8)12(15)16/h2-4H,5H2,1H3,(H,13,14)/p-1