N-(2,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(2,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(2,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4/c1-7-4-5-8(2)9(6-7)14-12(18)10-11(17(19)20)13(21-3)16-15-10/h4-6H,1-3H3,(H,14,18)(H,15,16)