1-[3-[10-(4-methoxyphenyl)anthracen-9-yl]-5-pyren-1-yl-phenyl]pyrene

Systemtic Name: 1-[3-[10-(4-methoxyphenyl)anthracen-9-yl]-5-pyren-1-yl-phenyl]pyrene Openeye Name: 1-[3-[10-(4-methoxyphenyl)-9-anthryl]-5-pyren-1-yl-phenyl]pyrene CAS Name: 1-[3-[10-(4-methoxyphenyl)-9-anthracenyl]-5-(1-pyrenyl)phenyl]pyrene IUPAC Name: 1-[3-[10-(4-methoxyphenyl)anthracen-9-yl]-5-pyren-1-ylphenyl]pyrene Traditional Name: 1-[3-[10-(4-methoxyphenyl)-9-anthryl]-5-pyren-1-yl-phenyl]pyrene Formula: C59H36O MolecularWeight: 760.91654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=CC=CC=C42)C5=CC(=CC(=C5)C6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=CC=CC=C42)C5=CC(=CC(=C5)C6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C59H36O/c1-60-45-26-20-39(21-27-45)56-48-12-2-4-14-50(48)57(51-15-5-3-13-49(51)56)44-33-42(46-28-22-40-18-16-35-8-6-10-37-24-30-52(46)58(40)54(35)37)32-43(34-44)47-29-23-41-19-17-36-9-7-11-38-25-31-53(47)59(41)55(36)38/h2-34H,1H3