N-(1,3-benzodioxol-5-ylmethylideneamino)-2-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-2-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyleneamino)-2-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-2-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-2-methyl-4-nitropyrazole-3-carboxamide Traditional Name: 2-methyl-4-nitro-N-(piperonylideneamino)pyrazole-3-carboxamide Formula: C13H11N5O5 MolecularWeight: 317.25694

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NN=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NN=CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H11N5O5/c1-17-12(9(6-15-17)18(20)21)13(19)16-14-5-8-2-3-10-11(4-8)23-7-22-10/h2-6H,7H2,1H3,(H,16,19)