2-[4-(4-butylphenyl)phenyl]-5-hexyl-oxane

Systemtic Name: 2-[4-(4-butylphenyl)phenyl]-5-hexyl-oxane Openeye Name: 2-[4-(4-butylphenyl)phenyl]-5-hexyl-tetrahydropyran CAS Name: 2-[4-(4-butylphenyl)phenyl]-5-hexyloxane IUPAC Name: 2-[4-(4-butylphenyl)phenyl]-5-hexyloxane Traditional Name: 2-[4-(4-butylphenyl)phenyl]-5-hexyl-tetrahydropyran Formula: C27H38O MolecularWeight: 378.59002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(OC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCCC1CCC(OC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C27H38O/c1-3-5-7-8-10-23-13-20-27(28-21-23)26-18-16-25(17-19-26)24-14-11-22(12-15-24)9-6-4-2/h11-12,14-19,23,27H,3-10,13,20-21H2,1-2H3