2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-nitro-guanidine

Systemtic Name: 2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-nitro-guanidine Openeye Name: 2-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-1-nitro-guanidine CAS Name: 2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-nitroguanidine IUPAC Name: 2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-nitroguanidine Traditional Name: 1-nitro-2-[(E)-piperonylideneamino]guanidine Formula: C9H9N5O4 MolecularWeight: 251.19886

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NN=C(N)N[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/N=C(/N)\N[N+](=O)[O-]

InChI

InChI=1S/C9H9N5O4/c10-9(13-14(15)16)12-11-4-6-1-2-7-8(3-6)18-5-17-7/h1-4H,5H2,(H3,10,12,13)/b11-4+