N-ethyl-7-nitro-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-imine

Systemtic Name: N-ethyl-7-nitro-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-imine Openeye Name: N-ethyl-4-hydroxy-7-nitro-1-oxido-1,2,4-benzotriazin-1-ium-3-imine CAS Name: N-ethyl-4-hydroxy-7-nitro-1-oxido-1,2,4-benzotriazin-1-ium-3-imine IUPAC Name: N-ethyl-4-hydroxy-7-nitro-1-oxido-1,2,4-benzotriazin-1-ium-3-imine Traditional Name: ethyl-(4-hydroxy-7-nitro-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amine Formula: C9H9N5O4 MolecularWeight: 251.19886

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C1N=[N+](C2=C(N1O)C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CCN=C1N=[N+](C2=C(N1O)C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C9H9N5O4/c1-2-10-9-11-13(16)8-5-6(14(17)18)3-4-7(8)12(9)15/h3-5,15H,2H2,1H3