4-[4-[2-(4-dodecoxyphenyl)ethynyl]phenyl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[4-[2-(4-dodecoxyphenyl)ethynyl]phenyl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[4-[2-(4-dodecoxyphenyl)ethynyl]phenyl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[4-[2-(4-dodecoxyphenyl)ethynyl]phenyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[4-[2-(4-dodecoxyphenyl)ethynyl]phenyl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[4-[2-(4-lauryloxyphenyl)ethynyl]phenyl]-2-methyl-but-3-yn-2-ol Formula: C31H40O2 MolecularWeight: 444.6481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC(C)(C)O

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC(C)(C)O

InChI

InChI=1S/C31H40O2/c1-4-5-6-7-8-9-10-11-12-13-26-33-30-22-20-28(21-23-30)15-14-27-16-18-29(19-17-27)24-25-31(2,3)32/h16-23,32H,4-13,26H2,1-3H3