[3,4-bis[2-(3,4-didodecoxyphenyl)ethynyl]phenyl]methanol

Systemtic Name: [3,4-bis[2-(3,4-didodecoxyphenyl)ethynyl]phenyl]methanol Openeye Name: [3,4-bis[2-(3,4-didodecoxyphenyl)ethynyl]phenyl]methanol CAS Name: [3,4-bis[2-(3,4-didodecoxyphenyl)ethynyl]phenyl]methanol IUPAC Name: [3,4-bis[2-(3,4-didodecoxyphenyl)ethynyl]phenyl]methanol Traditional Name: [3,4-bis[2-(3,4-dilauryloxyphenyl)ethynyl]phenyl]methanol Formula: C71H112O5 MolecularWeight: 1045.64598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C#CC2=C(C=C(C=C2)CO)C#CC3=CC(=C(C=C3)OCCCCCCCCCCCC)OCCCCCCCCCCCC)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C#CC2=C(C=C(C=C2)CO)C#CC3=CC(=C(C=C3)OCCCCCCCCCCCC)OCCCCCCCCCCCC)OCCCCCCCCCCCC

InChI

InChI=1S/C71H112O5/c1-5-9-13-17-21-25-29-33-37-41-55-73-68-53-48-63(60-70(68)75-57-43-39-35-31-27-23-19-15-11-7-3)45-50-66-51-47-65(62-72)59-67(66)52-46-64-49-54-69(74-56-42-38-34-30-26-22-18-14-10-6-2)71(61-64)76-58-44-40-36-32-28-24-20-16-12-8-4/h47-49,51,53-54,59-61,72H,5-44,55-58,62H2,1-4H3