5-(2-methylpropyl)-4-nitro-1H-pyrazole-3-carboxylate

Systemtic Name: 5-(2-methylpropyl)-4-nitro-1H-pyrazole-3-carboxylate Openeye Name: 5-isobutyl-4-nitro-1H-pyrazole-3-carboxylate CAS Name: 5-(2-methylpropyl)-4-nitro-1H-pyrazole-3-carboxylate IUPAC Name: 5-(2-methylpropyl)-4-nitro-1H-pyrazole-3-carboxylate Traditional Name: 5-isobutyl-4-nitro-1H-pyrazole-3-carboxylate Formula: C8H10N3O4- MolecularWeight: 212.1827

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N3O4/c1-4(2)3-5-7(11(14)15)6(8(12)13)10-9-5/h4H,3H2,1-2H3,(H,9,10)(H,12,13)/p-1