7-chloranyl-5-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole

Systemtic Name: 7-chloranyl-5-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole Openeye Name: 7-chloro-5-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole CAS Name: 7-chloro-5-(4-methyl-1-piperazin-4-iumyl)-4-nitro-2,1,3-benzoxadiazole IUPAC Name: 7-chloro-5-(4-methylpiperazin-4-ium-1-yl)-4-nitro-2,1,3-benzoxadiazole Traditional Name: 7-chloro-5-(4-methylpiperazin-4-ium-1-yl)-4-nitro-benzofurazan Formula: C11H13ClN5O3+ MolecularWeight: 298.70562

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C3=NON=C3C(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C3=NON=C3C(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H12ClN5O3/c1-15-2-4-16(5-3-15)8-6-7(12)9-10(14-20-13-9)11(8)17(18)19/h6H,2-5H2,1H3/p+1