N-phenyl-N-[4-[4-[phenyl(pyren-2-yl)amino]phenyl]phenyl]pyren-2-amine

Systemtic Name: N-phenyl-N-[4-[4-[phenyl(pyren-2-yl)amino]phenyl]phenyl]pyren-2-amine Openeye Name: N-phenyl-N-[4-[4-(N-pyren-2-ylanilino)phenyl]phenyl]pyren-2-amine CAS Name: N-phenyl-N-[4-[4-[N-(2-pyrenyl)anilino]phenyl]phenyl]-2-pyrenamine IUPAC Name: N-phenyl-N-[4-[4-(N-pyren-2-ylanilino)phenyl]phenyl]pyren-2-amine Traditional Name: phenyl-pyren-2-yl-[4-[4-(N-pyren-2-ylanilino)phenyl]phenyl]amine Formula: C56H36N2 MolecularWeight: 736.89844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C7C(=C5)C=CC8=C7C(=CC=C8)C=C6)C9=CC1=C2C(=C9)C=CC3=C2C(=CC=C3)C=C1

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C7C(=C5)C=CC8=C7C(=CC=C8)C=C6)C9=CC1=C2C(=C9)C=CC3=C2C(=CC=C3)C=C1

InChI

InChI=1S/C56H36N2/c1-3-13-47(14-4-1)57(51-33-43-21-17-39-9-7-10-40-18-22-44(34-51)55(43)53(39)40)49-29-25-37(26-30-49)38-27-31-50(32-28-38)58(48-15-5-2-6-16-48)52-35-45-23-19-41-11-8-12-42-20-24-46(36-52)56(45)54(41)42/h1-36H