7-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole

Systemtic Name: 7-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole Openeye Name: 7-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole CAS Name: 7-(4-methyl-1-piperazin-4-iumyl)-4-nitro-2,1,3-benzoxadiazole IUPAC Name: 7-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-7-nitro-benzofurazan Formula: C11H14N5O3+ MolecularWeight: 264.26056

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C3=NON=C23)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C3=NON=C23)[N+](=O)[O-]

InChI

InChI=1S/C11H13N5O3/c1-14-4-6-15(7-5-14)8-2-3-9(16(17)18)11-10(8)12-19-13-11/h2-3H,4-7H2,1H3/p+1