3-nitro-1-nonyl-pyrazole-4-carbonitrile

Systemtic Name: 3-nitro-1-nonyl-pyrazole-4-carbonitrile Openeye Name: 3-nitro-1-nonyl-pyrazole-4-carbonitrile CAS Name: 3-nitro-1-nonyl-4-pyrazolecarbonitrile IUPAC Name: 3-nitro-1-nonylpyrazole-4-carbonitrile Traditional Name: 3-nitro-1-nonyl-pyrazole-4-carbonitrile Formula: C13H20N4O2 MolecularWeight: 264.3235

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C=C(C(=N1)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCCCCCCN1C=C(C(=N1)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H20N4O2/c1-2-3-4-5-6-7-8-9-16-11-12(10-14)13(15-16)17(18)19/h11H,2-9H2,1H3