2-(4-nitrophenyl)-5-phenyl-4H-benzo[h][1,3,4]benzotriazepin-1-ium

Systemtic Name: 2-(4-nitrophenyl)-5-phenyl-4H-benzo[h][1,3,4]benzotriazepin-1-ium Openeye Name: 2-(4-nitrophenyl)-5-phenyl-4H-benzo[h][1,3,4]benzotriazepin-1-ium CAS Name: 2-(4-nitrophenyl)-5-phenyl-4H-benzo[h][1,3,4]benzotriazepin-1-ium IUPAC Name: 2-(4-nitrophenyl)-5-phenyl-4H-benzo[h][1,3,4]benzotriazepin-1-ium Traditional Name: 2-(4-nitrophenyl)-5-phenyl-4H-benzo[h][1,3,4]benzotriazepin-1-ium Formula: C24H17N4O2+ MolecularWeight: 393.41738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C4C=CC=CC4=CC3=[NH+]C(=NN2)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C4C=CC=CC4=CC3=[NH+]C(=NN2)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H16N4O2/c29-28(30)20-12-10-17(11-13-20)24-25-22-15-19-9-5-4-8-18(19)14-21(22)23(26-27-24)16-6-2-1-3-7-16/h1-15,26H/p+1