1-[4-[10-(4-pyren-1-ylphenyl)anthracen-9-yl]phenyl]pyrene

Systemtic Name: 1-[4-[10-(4-pyren-1-ylphenyl)anthracen-9-yl]phenyl]pyrene Openeye Name: 1-[4-[10-(4-pyren-1-ylphenyl)-9-anthryl]phenyl]pyrene CAS Name: 1-[4-[10-[4-(1-pyrenyl)phenyl]-9-anthracenyl]phenyl]pyrene IUPAC Name: 1-[4-[10-(4-pyren-1-ylphenyl)anthracen-9-yl]phenyl]pyrene Traditional Name: 1-[4-[10-(4-pyren-1-ylphenyl)-9-anthryl]phenyl]pyrene Formula: C58H34 MolecularWeight: 730.89056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2C4=CC=C(C=C4)C5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)C9=CC=C(C=C9)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2C4=CC=C(C=C4)C5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)C9=CC=C(C=C9)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C58H34/c1-2-12-48-47(11-1)55(41-19-15-35(16-20-41)45-31-27-43-25-23-37-7-5-9-39-29-33-51(45)57(43)53(37)39)49-13-3-4-14-50(49)56(48)42-21-17-36(18-22-42)46-32-28-44-26-24-38-8-6-10-40-30-34-52(46)58(44)54(38)40/h1-34H