(2S,5R)-2-(4-butylphenyl)-5-(4-ethylphenyl)-1,4-dioxane

Systemtic Name: (2S,5R)-2-(4-butylphenyl)-5-(4-ethylphenyl)-1,4-dioxane Openeye Name: (2S,5R)-2-(4-butylphenyl)-5-(4-ethylphenyl)-1,4-dioxane CAS Name: (2S,5R)-2-(4-butylphenyl)-5-(4-ethylphenyl)-1,4-dioxane IUPAC Name: (2S,5R)-2-(4-butylphenyl)-5-(4-ethylphenyl)-1,4-dioxane Traditional Name: (2S,5R)-2-(4-butylphenyl)-5-(4-ethylphenyl)-1,4-dioxane Formula: C22H28O2 MolecularWeight: 324.45652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2COC(CO2)C3=CC=C(C=C3)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)[C@H]2CO[C@@H](CO2)C3=CC=C(C=C3)CC

InChI

InChI=1S/C22H28O2/c1-3-5-6-18-9-13-20(14-10-18)22-16-23-21(15-24-22)19-11-7-17(4-2)8-12-19/h7-14,21-22H,3-6,15-16H2,1-2H3/t21-,22+/m0/s1