1-cycloheptyl-4-(4-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane

Systemtic Name: 1-cycloheptyl-4-(4-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane Openeye Name: 1-cycloheptyl-4-(4-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane CAS Name: 1-cycloheptyl-4-(4-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane IUPAC Name: 1-cycloheptyl-4-(4-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane Traditional Name: 1-cycloheptyl-4-(4-ethynylphenyl)-3,5,8-trioxabicyclo[2.2.2]octane Formula: C20H24O3 MolecularWeight: 312.40276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)C23OCC(CO2)(CO3)C4CCCCCC4

Isomeric SMILES

C#CC1=CC=C(C=C1)C23OCC(CO2)(CO3)C4CCCCCC4

InChI

InChI=1S/C20H24O3/c1-2-16-9-11-18(12-10-16)20-21-13-19(14-22-20,15-23-20)17-7-5-3-4-6-8-17/h1,9-12,17H,3-8,13-15H2