N-(1,3-benzodioxol-5-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C13H12N4O5 MolecularWeight: 304.25818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C13H12N4O5/c1-7-11(17(19)20)12(16(2)15-7)13(18)14-8-3-4-9-10(5-8)22-6-21-9/h3-5H,6H2,1-2H3,(H,14,18)