2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfonyl]ethanoate

Systemtic Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfonyl]ethanoate Openeye Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfonyl]acetate CAS Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfonyl]acetate IUPAC Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfonyl]acetate Traditional Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfonyl]acetate Formula: C6H6N3O6S- MolecularWeight: 248.19334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)S(=O)(=O)CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)S(=O)(=O)CC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H7N3O6S/c1-3-5(9(12)13)6(8-7-3)16(14,15)2-4(10)11/h2H2,1H3,(H,7,8)(H,10,11)/p-1