4-(4-bromanyl-3-nitro-pyrazol-1-yl)butanoate

Systemtic Name: 4-(4-bromanyl-3-nitro-pyrazol-1-yl)butanoate Openeye Name: 4-(4-bromo-3-nitro-pyrazol-1-yl)butanoate CAS Name: 4-(4-bromo-3-nitro-1-pyrazolyl)butanoate IUPAC Name: 4-(4-bromo-3-nitropyrazol-1-yl)butanoate Traditional Name: 4-(4-bromo-3-nitro-pyrazol-1-yl)butyrate Formula: C7H7BrN3O4- MolecularWeight: 277.05218

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NN1CCCC(=O)[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=C(C(=NN1CCCC(=O)[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C7H8BrN3O4/c8-5-4-10(3-1-2-6(12)13)9-7(5)11(14)15/h4H,1-3H2,(H,12,13)/p-1