2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1-oxidanyl-guanidine

Systemtic Name: 2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1-oxidanyl-guanidine Openeye Name: 1-hydroxy-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]guanidine CAS Name: 1-hydroxy-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]guanidine IUPAC Name: 1-hydroxy-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]guanidine Traditional Name: 1-hydroxy-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]guanidine Formula: C9H9N5O5 MolecularWeight: 267.19826

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NN=C(N)NO)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/N=C(/N)\NO)[N+](=O)[O-]

InChI

InChI=1S/C9H9N5O5/c10-9(13-15)12-11-3-5-1-7-8(19-4-18-7)2-6(5)14(16)17/h1-3,15H,4H2,(H3,10,12,13)/b11-3+