N2,N2,N7,N7-tetrakis(3-phenylphenyl)-4,5,9,10-tetrahydropyrene-2,7-diamine

Systemtic Name: N2,N2,N7,N7-tetrakis(3-phenylphenyl)-4,5,9,10-tetrahydropyrene-2,7-diamine Openeye Name: N2,N2,N7,N7-tetrakis(3-phenylphenyl)-4,5,9,10-tetrahydropyrene-2,7-diamine CAS Name: N2,N2,N7,N7-tetrakis(3-phenylphenyl)-4,5,9,10-tetrahydropyrene-2,7-diamine IUPAC Name: 2-N,2-N,7-N,7-N-tetrakis(3-phenylphenyl)-4,5,9,10-tetrahydropyrene-2,7-diamine Traditional Name: bis(3-phenylphenyl)-[7-(3-phenyl-N-(3-phenylphenyl)anilino)-4,5,9,10-tetrahydropyren-2-yl]amine Formula: C64H48N2 MolecularWeight: 845.07932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=CC3=C2C4=C(CC3)C=C(C=C41)N(C5=CC=CC(=C5)C6=CC=CC=C6)C7=CC=CC(=C7)C8=CC=CC=C8)N(C9=CC=CC(=C9)C1=CC=CC=C1)C1=CC=CC(=C1)C1=CC=CC=C1

Isomeric SMILES

C1CC2=CC(=CC3=C2C4=C(CC3)C=C(C=C41)N(C5=CC=CC(=C5)C6=CC=CC=C6)C7=CC=CC(=C7)C8=CC=CC=C8)N(C9=CC=CC(=C9)C1=CC=CC=C1)C1=CC=CC(=C1)C1=CC=CC=C1

InChI

InChI=1S/C64H48N2/c1-5-17-45(18-6-1)49-25-13-29-57(37-49)65(58-30-14-26-50(38-58)46-19-7-2-8-20-46)61-41-53-33-35-55-43-62(44-56-36-34-54(42-61)63(53)64(55)56)66(59-31-15-27-51(39-59)47-21-9-3-10-22-47)60-32-16-28-52(40-60)48-23-11-4-12-24-48/h1-32,37-44H,33-36H2