4-nitro-7-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-2,1,3-benzoxadiazole

Systemtic Name: 4-nitro-7-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-2,1,3-benzoxadiazole Openeye Name: 4-nitro-7-[4-(3-pyridylmethyl)piperazin-1-yl]-2,1,3-benzoxadiazole CAS Name: 4-nitro-7-[4-(3-pyridinylmethyl)-1-piperazinyl]-2,1,3-benzoxadiazole IUPAC Name: 4-nitro-7-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-2,1,3-benzoxadiazole Traditional Name: 4-nitro-7-[4-(3-pyridylmethyl)piperazino]benzofurazan Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O3/c23-22(24)14-4-3-13(15-16(14)19-25-18-15)21-8-6-20(7-9-21)11-12-2-1-5-17-10-12/h1-5,10H,6-9,11H2