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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=NN(C=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=NN(C=C3[N+](=O)[O-])C

InChI

InChI=1S/C17H18N6O3/c1-11-14(12(2)22(19-11)13-7-5-4-6-8-13)9-18-17(24)16-15(23(25)26)10-21(3)20-16/h4-8,10H,9H2,1-3H3,(H,18,24)