3-(4-nitropyrazol-1-yl)butanenitrile

Systemtic Name: 3-(4-nitropyrazol-1-yl)butanenitrile Openeye Name: 3-(4-nitropyrazol-1-yl)butanenitrile CAS Name: 3-(4-nitro-1-pyrazolyl)butanenitrile IUPAC Name: 3-(4-nitropyrazol-1-yl)butanenitrile Traditional Name: 3-(4-nitropyrazol-1-yl)butyronitrile Formula: C7H8N4O2 MolecularWeight: 180.16402

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)N1C=C(C=N1)[N+](=O)[O-]

Isomeric SMILES

CC(CC#N)N1C=C(C=N1)[N+](=O)[O-]

InChI

InChI=1S/C7H8N4O2/c1-6(2-3-8)10-5-7(4-9-10)11(12)13/h4-6H,2H2,1H3