2-[(2-methyl-5-nitro-phenyl)sulfonylamino]ethanoate

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]ethanoate Openeye Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]acetate CAS Name: 2-[(2-methyl-5-nitrophenyl)sulfonylamino]acetate IUPAC Name: 2-[(2-methyl-5-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]acetate Formula: C9H9N2O6S- MolecularWeight: 273.24256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC(=O)[O-]

InChI

InChI=1S/C9H10N2O6S/c1-6-2-3-7(11(14)15)4-8(6)18(16,17)10-5-9(12)13/h2-4,10H,5H2,1H3,(H,12,13)/p-1