N2,N2,N6,N6,N10,N10-hexakis(4-methylphenyl)triphenylene-2,6,10-triamine

Systemtic Name: N2,N2,N6,N6,N10,N10-hexakis(4-methylphenyl)triphenylene-2,6,10-triamine Openeye Name: N2,N2,N6,N6,N10,N10-hexakis(p-tolyl)triphenylene-2,6,10-triamine CAS Name: N2,N2,N6,N6,N10,N10-hexakis(4-methylphenyl)triphenylene-2,6,10-triamine IUPAC Name: 2-N,2-N,6-N,6-N,10-N,10-N-hexakis(4-methylphenyl)triphenylene-2,6,10-triamine Traditional Name: [6,10-bis[4-methyl-N-(p-tolyl)anilino]triphenylen-2-yl]-bis(p-tolyl)amine Formula: C60H51N3 MolecularWeight: 814.06704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC4=C5C=CC(=CC5=C6C=CC(=CC6=C4C=C3)N(C7=CC=C(C=C7)C)C8=CC=C(C=C8)C)N(C9=CC=C(C=C9)C)C1=CC=C(C=C1)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC4=C5C=CC(=CC5=C6C=CC(=CC6=C4C=C3)N(C7=CC=C(C=C7)C)C8=CC=C(C=C8)C)N(C9=CC=C(C=C9)C)C1=CC=C(C=C1)C

InChI

InChI=1S/C60H51N3/c1-40-7-19-46(20-8-40)61(47-21-9-41(2)10-22-47)52-31-34-55-58(37-52)56-35-32-53(62(48-23-11-42(3)12-24-48)49-25-13-43(4)14-26-49)39-60(56)57-36-33-54(38-59(55)57)63(50-27-15-44(5)16-28-50)51-29-17-45(6)18-30-51/h7-39H,1-6H3