2-[[2,4-bis(fluoranyl)-5-nitro-phenyl]sulfonyl-methyl-amino]ethanoate

Systemtic Name: 2-[[2,4-bis(fluoranyl)-5-nitro-phenyl]sulfonyl-methyl-amino]ethanoate Openeye Name: 2-[(2,4-difluoro-5-nitro-phenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(2,4-difluoro-5-nitrophenyl)sulfonyl-methylamino]acetate IUPAC Name: 2-[(2,4-difluoro-5-nitrophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(2,4-difluoro-5-nitro-phenyl)sulfonyl-methyl-amino]acetate Formula: C9H7F2N2O6S- MolecularWeight: 309.223486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8F2N2O6S/c1-12(4-9(14)15)20(18,19)8-3-7(13(16)17)5(10)2-6(8)11/h2-3H,4H2,1H3,(H,14,15)/p-1