1-methyl-4-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]pyrazole-3-carboxamide

Systemtic Name: 1-methyl-4-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]pyrazole-3-carboxamide Openeye Name: 1-methyl-4-nitro-N-[(E)-(3-nitrophenyl)methyleneamino]pyrazole-3-carboxamide CAS Name: 1-methyl-4-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-methyl-4-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]pyrazole-3-carboxamide Traditional Name: 1-methyl-4-nitro-N-[(E)-(3-nitrobenzylidene)amino]pyrazole-3-carboxamide Formula: C12H10N6O5 MolecularWeight: 318.245

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN1C=C(C(=N1)C(=O)N/N=C/C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H10N6O5/c1-16-7-10(18(22)23)11(15-16)12(19)14-13-6-8-3-2-4-9(5-8)17(20)21/h2-7H,1H3,(H,14,19)/b13-6+