3-[2,5-dihexyl-4-[2-[4-(oxan-2-yloxy)phenyl]ethynyl]phenyl]prop-2-yn-1-ol

Systemtic Name: 3-[2,5-dihexyl-4-[2-[4-(oxan-2-yloxy)phenyl]ethynyl]phenyl]prop-2-yn-1-ol Openeye Name: 3-[2,5-dihexyl-4-[2-(4-tetrahydropyran-2-yloxyphenyl)ethynyl]phenyl]prop-2-yn-1-ol CAS Name: 3-[2,5-dihexyl-4-[2-[4-(2-oxanyloxy)phenyl]ethynyl]phenyl]-2-propyn-1-ol IUPAC Name: 3-[2,5-dihexyl-4-[2-[4-(oxan-2-yloxy)phenyl]ethynyl]phenyl]prop-2-yn-1-ol Traditional Name: 3-[2,5-dihexyl-4-[2-(4-tetrahydropyran-2-yloxyphenyl)ethynyl]phenyl]prop-2-yn-1-ol Formula: C34H44O3 MolecularWeight: 500.71136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1C#CC2=CC=C(C=C2)OC3CCCCO3)CCCCCC)C#CCO

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1C#CC2=CC=C(C=C2)OC3CCCCO3)CCCCCC)C#CCO

InChI

InChI=1S/C34H44O3/c1-3-5-7-9-14-29-27-32(30(15-10-8-6-4-2)26-31(29)16-13-24-35)21-18-28-19-22-33(23-20-28)37-34-17-11-12-25-36-34/h19-20,22-23,26-27,34-35H,3-12,14-15,17,24-25H2,1-2H3