2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)-1-oxidanidyl-piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)-1-oxidanidyl-piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)-1-oxido-piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)-1-oxido-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)-1-oxidopiperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(7-nitrobenzofurazan-4-yl)-1-oxido-piperazin-1-ium-1-yl]ethanol Formula: C12H15N5O5 MolecularWeight: 309.278

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1C2=CC=C(C3=NON=C23)[N+](=O)[O-])(CCO)[O-]

Isomeric SMILES

C1C[N+](CCN1C2=CC=C(C3=NON=C23)[N+](=O)[O-])(CCO)[O-]

InChI

InChI=1S/C12H15N5O5/c18-8-7-17(21)5-3-15(4-6-17)9-1-2-10(16(19)20)12-11(9)13-22-14-12/h1-2,18H,3-8H2