1-(4-bromanylbutyl)-3,5-dimethyl-4-nitro-pyrazole

Systemtic Name: 1-(4-bromanylbutyl)-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-(4-bromobutyl)-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-(4-bromobutyl)-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-(4-bromobutyl)-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-(4-bromobutyl)-3,5-dimethyl-4-nitro-pyrazole Formula: C9H14BrN3O2 MolecularWeight: 276.13036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCCBr)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCCBr)C)[N+](=O)[O-]

InChI

InChI=1S/C9H14BrN3O2/c1-7-9(13(14)15)8(2)12(11-7)6-4-3-5-10/h3-6H2,1-2H3