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

Systemtic Name: 7-[4-(3-chlorophenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole Openeye Name: 7-[4-(3-chlorophenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole CAS Name: 7-[4-(3-chlorophenyl)-1-piperazinyl]-4-nitro-2,1,3-benzoxadiazole IUPAC Name: 7-[4-(3-chlorophenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-7-nitro-benzofurazan Formula: C16H14ClN5O3 MolecularWeight: 359.76706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN5O3/c17-11-2-1-3-12(10-11)20-6-8-21(9-7-20)13-4-5-14(22(23)24)16-15(13)18-25-19-16/h1-5,10H,6-9H2