4,6-dinitro-1-oxidanidyl-N-(phenylmethyl)pyridazin-1-ium-3-amine

Systemtic Name: 4,6-dinitro-1-oxidanidyl-N-(phenylmethyl)pyridazin-1-ium-3-amine Openeye Name: N-benzyl-4,6-dinitro-1-oxido-pyridazin-1-ium-3-amine CAS Name: 4,6-dinitro-1-oxido-N-(phenylmethyl)-3-pyridazin-1-iumamine IUPAC Name: N-benzyl-4,6-dinitro-1-oxidopyridazin-1-ium-3-amine Traditional Name: benzyl-(4,6-dinitro-1-oxido-pyridazin-1-ium-3-yl)amine Formula: C11H9N5O5 MolecularWeight: 291.21966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=N[N+](=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=N[N+](=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-]

InChI

InChI=1S/C11H9N5O5/c17-14-10(16(20)21)6-9(15(18)19)11(13-14)12-7-8-4-2-1-3-5-8/h1-6H,7H2,(H,12,13)