4-nitro-5-(2-pyridin-3-ylpiperidin-1-yl)-2,1,3-benzoxadiazole

Systemtic Name: 4-nitro-5-(2-pyridin-3-ylpiperidin-1-yl)-2,1,3-benzoxadiazole Openeye Name: 4-nitro-5-[2-(3-pyridyl)-1-piperidyl]-2,1,3-benzoxadiazole CAS Name: 4-nitro-5-[2-(3-pyridinyl)-1-piperidinyl]-2,1,3-benzoxadiazole IUPAC Name: 4-nitro-5-(2-pyridin-3-ylpiperidin-1-yl)-2,1,3-benzoxadiazole Traditional Name: 4-nitro-5-[2-(3-pyridyl)piperidino]benzofurazan Formula: C16H15N5O3 MolecularWeight: 325.322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)C3=C(C4=NON=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)C3=C(C4=NON=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O3/c22-21(23)16-14(7-6-12-15(16)19-24-18-12)20-9-2-1-5-13(20)11-4-3-8-17-10-11/h3-4,6-8,10,13H,1-2,5,9H2