2-decoxy-9,10-bis(6-hexylnaphthalen-2-yl)-6-[2-methyl-5-(4-methylphenyl)phenoxy]anthracene

Systemtic Name: 2-decoxy-9,10-bis(6-hexylnaphthalen-2-yl)-6-[2-methyl-5-(4-methylphenyl)phenoxy]anthracene Openeye Name: 2-decoxy-9,10-bis(6-hexyl-2-naphthyl)-6-[2-methyl-5-(p-tolyl)phenoxy]anthracene CAS Name: 2-decoxy-9,10-bis(6-hexyl-2-naphthalenyl)-6-[2-methyl-5-(4-methylphenyl)phenoxy]anthracene IUPAC Name: 2-decoxy-9,10-bis(6-hexylnaphthalen-2-yl)-6-[2-methyl-5-(4-methylphenyl)phenoxy]anthracene Traditional Name: 2-decoxy-9,10-bis(6-hexyl-2-naphthyl)-6-[2-methyl-5-(p-tolyl)phenoxy]anthracene Formula: C70H78O2 MolecularWeight: 951.36712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC2=C(C3=C(C=C(C=C3)OC4=C(C=CC(=C4)C5=CC=C(C=C5)C)C)C(=C2C=C1)C6=CC7=C(C=C6)C=C(C=C7)CCCCCC)C8=CC9=C(C=C8)C=C(C=C9)CCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC2=C(C3=C(C=C(C=C3)OC4=C(C=CC(=C4)C5=CC=C(C=C5)C)C)C(=C2C=C1)C6=CC7=C(C=C6)C=C(C=C7)CCCCCC)C8=CC9=C(C=C8)C=C(C=C9)CCCCCC

InChI

InChI=1S/C70H78O2/c1-6-9-12-15-16-17-18-21-42-71-62-38-40-64-66(48-62)69(60-36-34-55-43-52(22-19-13-10-7-2)27-32-57(55)45-60)65-41-39-63(72-68-47-59(31-26-51(68)5)54-29-24-50(4)25-30-54)49-67(65)70(64)61-37-35-56-44-53(23-20-14-11-8-3)28-33-58(56)46-61/h24-41,43-49H,6-23,42H2,1-5H3