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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCN(CC1)C2=CC=C(C3=[N+](ON=C23)[O-])[N+](=O)[O-])O

Isomeric SMILES

CC(N1CCN(CC1)C2=CC=C(C3=[N+](ON=C23)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C12H15N5O5/c1-8(18)14-4-6-15(7-5-14)9-2-3-10(16(19)20)12-11(9)13-22-17(12)21/h2-3,8,18H,4-7H2,1H3