7-[4-(diphenylmethyl)piperazin-1-yl]-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole

Systemtic Name: 7-[4-(diphenylmethyl)piperazin-1-yl]-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole Openeye Name: 7-(4-benzhydrylpiperazin-1-yl)-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole CAS Name: 7-[4-(diphenylmethyl)-1-piperazinyl]-4-nitro-5-(1-pyrrolidinyl)-2,1,3-benzoxadiazole IUPAC Name: 7-(4-benzhydrylpiperazin-1-yl)-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole Traditional Name: 7-(4-benzhydrylpiperazino)-4-nitro-5-pyrrolidino-benzofurazan Formula: C27H28N6O3 MolecularWeight: 484.54962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C3=NON=C3C(=C2)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C3=NON=C3C(=C2)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C27H28N6O3/c34-33(35)27-23(30-13-7-8-14-30)19-22(24-25(27)29-36-28-24)31-15-17-32(18-16-31)26(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,19,26H,7-8,13-18H2