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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=CC=C(C3=NO[N+](=C23)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCO)C2=CC=C(C3=NO[N+](=C23)[O-])[N+](=O)[O-]

InChI

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