5-butyl-2-(4-heptylphenyl)oxane

Systemtic Name: 5-butyl-2-(4-heptylphenyl)oxane Openeye Name: 5-butyl-2-(4-heptylphenyl)tetrahydropyran CAS Name: 5-butyl-2-(4-heptylphenyl)oxane IUPAC Name: 5-butyl-2-(4-heptylphenyl)oxane Traditional Name: 5-butyl-2-(4-heptylphenyl)tetrahydropyran Formula: C22H36O MolecularWeight: 316.52064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2CCC(CO2)CCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2CCC(CO2)CCCC

InChI

InChI=1S/C22H36O/c1-3-5-7-8-9-11-19-12-15-21(16-13-19)22-17-14-20(18-23-22)10-6-4-2/h12-13,15-16,20,22H,3-11,14,17-18H2,1-2H3