azanyl-[3,5-bis[azanyl(diphenyl)azaniumyl]-2,4,6-tricyano-phenyl]-diphenyl-azanium

Systemtic Name: azanyl-[3,5-bis[azanyl(diphenyl)azaniumyl]-2,4,6-tricyano-phenyl]-diphenyl-azanium Openeye Name: amino-[3,5-bis[amino(diphenyl)ammonio]-2,4,6-tricyano-phenyl]-diphenyl-ammonium CAS Name: amino-[3,5-bis[amino(diphenyl)ammonio]-2,4,6-tricyanophenyl]-diphenylammonium IUPAC Name: amino-[3,5-bis[amino(diphenyl)azaniumyl]-2,4,6-tricyanophenyl]-diphenylazanium Traditional Name: amino-[3,5-bis[amino(diphenyl)ammonio]-2,4,6-tricyano-phenyl]-diphenyl-ammonium Formula: C45H36N9+3 MolecularWeight: 702.82764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+](C2=CC=CC=C2)(C3=C(C(=C(C(=C3C#N)[N+](C4=CC=CC=C4)(C5=CC=CC=C5)N)C#N)[N+](C6=CC=CC=C6)(C7=CC=CC=C7)N)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)[N+](C2=CC=CC=C2)(C3=C(C(=C(C(=C3C#N)[N+](C4=CC=CC=C4)(C5=CC=CC=C5)N)C#N)[N+](C6=CC=CC=C6)(C7=CC=CC=C7)N)C#N)N

InChI

InChI=1S/C45H36N9/c46-31-40-43(52(49,34-19-7-1-8-20-34)35-21-9-2-10-22-35)41(32-47)45(54(51,38-27-15-5-16-28-38)39-29-17-6-18-30-39)42(33-48)44(40)53(50,36-23-11-3-12-24-36)37-25-13-4-14-26-37/h1-30H,49-51H2/q+3