3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]propanenitrile

Systemtic Name: 3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]propanenitrile Openeye Name: 3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]propanenitrile CAS Name: 3-[(2,5-dimethyl-4-nitro-3-pyrazolyl)-methylamino]propanenitrile IUPAC Name: 3-[(2,5-dimethyl-4-nitropyrazol-3-yl)-methylamino]propanenitrile Traditional Name: 3-[(2,5-dimethyl-4-nitro-pyrazol-3-yl)-methyl-amino]propionitrile Formula: C9H13N5O2 MolecularWeight: 223.23182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])N(C)CCC#N)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])N(C)CCC#N)C

InChI

InChI=1S/C9H13N5O2/c1-7-8(14(15)16)9(13(3)11-7)12(2)6-4-5-10/h4,6H2,1-3H3