1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-prop-2-enyl-pyrazole-3-carboxamide

Systemtic Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-prop-2-enyl-pyrazole-3-carboxamide Openeye Name: N-allyl-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: 1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-prop-2-enyl-3-pyrazolecarboxamide IUPAC Name: 1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-prop-2-enylpyrazole-3-carboxamide Traditional Name: N-allyl-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C13H16N6O3 MolecularWeight: 304.30454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NCC=C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NCC=C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N6O3/c1-4-6-14-13(20)11-5-7-17(16-11)8-18-10(3)12(19(21)22)9(2)15-18/h4-5,7H,1,6,8H2,2-3H3,(H,14,20)