4-[3,6,8-tri(dibenzofuran-4-yl)pyren-1-yl]dibenzofuran

Systemtic Name: 4-[3,6,8-tri(dibenzofuran-4-yl)pyren-1-yl]dibenzofuran Openeye Name: 4-[3,6,8-tri(dibenzofuran-4-yl)pyren-1-yl]dibenzofuran CAS Name: 4-[3,6,8-tris(4-dibenzofuranyl)-1-pyrenyl]dibenzofuran IUPAC Name: 4-[3,6,8-tri(dibenzofuran-4-yl)pyren-1-yl]dibenzofuran Traditional Name: 4-[3,6,8-tri(dibenzofuran-4-yl)pyren-1-yl]dibenzofuran Formula: C64H34O4 MolecularWeight: 866.95236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC(=C5C=CC6=C(C=C(C7=C6C5=C4C=C7)C8=CC=CC9=C8OC1=CC=CC=C91)C1=CC=CC2=C1OC1=CC=CC=C21)C1=CC=CC2=C1OC1=CC=CC=C21

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC(=C5C=CC6=C(C=C(C7=C6C5=C4C=C7)C8=CC=CC9=C8OC1=CC=CC=C91)C1=CC=CC2=C1OC1=CC=CC=C21)C1=CC=CC2=C1OC1=CC=CC=C21

InChI

InChI=1S/C64H34O4/c1-5-25-55-35(13-1)43-17-9-21-47(61(43)65-55)51-33-52(48-22-10-18-44-36-14-2-6-26-56(36)66-62(44)48)40-31-32-42-54(50-24-12-20-46-38-16-4-8-28-58(38)68-64(46)50)34-53(41-30-29-39(51)59(40)60(41)42)49-23-11-19-45-37-15-3-7-27-57(37)67-63(45)49/h1-34H