7-nitro-3-oxidanidyl-N-(2-pyridin-2-ylethyl)-2,1,3-benzoxadiazol-3-ium-4-amine

Systemtic Name: 7-nitro-3-oxidanidyl-N-(2-pyridin-2-ylethyl)-2,1,3-benzoxadiazol-3-ium-4-amine Openeye Name: 7-nitro-3-oxido-N-[2-(2-pyridyl)ethyl]-2,1,3-benzoxadiazol-3-ium-4-amine CAS Name: 7-nitro-3-oxido-N-[2-(2-pyridinyl)ethyl]-2,1,3-benzoxadiazol-3-ium-4-amine IUPAC Name: 7-nitro-3-oxido-N-(2-pyridin-2-ylethyl)-2,1,3-benzoxadiazol-3-ium-4-amine Traditional Name: (7-nitro-3-oxido-benzofurazan-3-ium-4-yl)-[2-(2-pyridyl)ethyl]amine Formula: C13H11N5O4 MolecularWeight: 301.25754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCNC2=CC=C(C3=NO[N+](=C23)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CCNC2=CC=C(C3=NO[N+](=C23)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O4/c19-17(20)11-5-4-10(13-12(11)16-22-18(13)21)15-8-6-9-3-1-2-7-14-9/h1-5,7,15H,6,8H2