9-[2,4,5-tri(phenanthren-9-yl)phenyl]phenanthrene

Systemtic Name: 9-[2,4,5-tri(phenanthren-9-yl)phenyl]phenanthrene Openeye Name: 9-[2,4,5-tris(9-phenanthryl)phenyl]phenanthrene CAS Name: 9-[2,4,5-tris(9-phenanthrenyl)phenyl]phenanthrene IUPAC Name: 9-[2,4,5-tri(phenanthren-9-yl)phenyl]phenanthrene Traditional Name: 9-[2,4,5-tris(9-phenanthryl)phenyl]phenanthrene Formula: C62H38 MolecularWeight: 782.96512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=CC(=C(C=C4C5=CC6=CC=CC=C6C7=CC=CC=C75)C8=CC9=CC=CC=C9C1=CC=CC=C18)C1=CC2=CC=CC=C2C2=CC=CC=C21

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=CC(=C(C=C4C5=CC6=CC=CC=C6C7=CC=CC=C75)C8=CC9=CC=CC=C9C1=CC=CC=C18)C1=CC2=CC=CC=C2C2=CC=CC=C21

InChI

InChI=1S/C62H38/c1-5-21-43-39(17-1)33-55(51-29-13-9-25-47(43)51)59-37-61(57-35-41-19-3-7-23-45(41)49-27-11-15-31-53(49)57)62(58-36-42-20-4-8-24-46(42)50-28-12-16-32-54(50)58)38-60(59)56-34-40-18-2-6-22-44(40)48-26-10-14-30-52(48)56/h1-38H