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

Systemtic Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-oxane Openeye Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-tetrahydropyran CAS Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyloxane IUPAC Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyloxane Traditional Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-tetrahydropyran Formula: C30H44O MolecularWeight: 420.66976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CO3)CCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CO3)CCCCCC

InChI

InChI=1S/C30H44O/c1-3-5-7-9-11-12-25-14-17-27(18-15-25)28-19-21-29(22-20-28)30-23-16-26(24-31-30)13-10-8-6-4-2/h14-15,17-22,26,30H,3-13,16,23-24H2,1-2H3