N,N'-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanediamide

Systemtic Name: N,N'-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]ethanediamide Openeye Name: N,N'-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]oxamide CAS Name: N,N'-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]oxamide IUPAC Name: N,N'-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]oxamide Traditional Name: N,N'-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]oxamide Formula: C18H12N6O10 MolecularWeight: 472.32208

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C(=O)NN=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)[N+](=O)[O-])/C=N/NC(=O)C(=O)N/N=C/C3=CC4=C(OCO4)C=C3[N+](=O)[O-]

InChI

InChI=1S/C18H12N6O10/c25-17(21-19-5-9-1-13-15(33-7-31-13)3-11(9)23(27)28)18(26)22-20-6-10-2-14-16(34-8-32-14)4-12(10)24(29)30/h1-6H,7-8H2,(H,21,25)(H,22,26)/b19-5+,20-6+