4-nitro-5-propan-2-yl-1H-pyrazole-3-carboxylate

Systemtic Name: 4-nitro-5-propan-2-yl-1H-pyrazole-3-carboxylate Openeye Name: 5-isopropyl-4-nitro-1H-pyrazole-3-carboxylate CAS Name: 4-nitro-5-propan-2-yl-1H-pyrazole-3-carboxylate IUPAC Name: 4-nitro-5-propan-2-yl-1H-pyrazole-3-carboxylate Traditional Name: 5-isopropyl-4-nitro-1H-pyrazole-3-carboxylate Formula: C7H8N3O4- MolecularWeight: 198.15612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=NN1)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O4/c1-3(2)4-6(10(13)14)5(7(11)12)9-8-4/h3H,1-2H3,(H,8,9)(H,11,12)/p-1