5-[4-(diphenylmethyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole

Systemtic Name: 5-[4-(diphenylmethyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazole Openeye Name: 5-(4-benzhydrylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazole CAS Name: 5-[4-(diphenylmethyl)-1-piperazinyl]-4-nitro-2,1,3-benzoxadiazole IUPAC Name: 5-(4-benzhydrylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazole Traditional Name: 5-(4-benzhydrylpiperazino)-4-nitro-benzofurazan Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C3=NON=C3C=C2)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C3=NON=C3C=C2)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H21N5O3/c29-28(30)23-20(12-11-19-21(23)25-31-24-19)26-13-15-27(16-14-26)22(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-12,22H,13-16H2