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

Systemtic Name: 5-heptyl-2-[4-(4-heptylphenyl)phenyl]oxane Openeye Name: 5-heptyl-2-[4-(4-heptylphenyl)phenyl]tetrahydropyran CAS Name: 5-heptyl-2-[4-(4-heptylphenyl)phenyl]oxane IUPAC Name: 5-heptyl-2-[4-(4-heptylphenyl)phenyl]oxane Traditional Name: 5-heptyl-2-[4-(4-heptylphenyl)phenyl]tetrahydropyran Formula: C31H46O MolecularWeight: 434.69634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(OC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCCC

Isomeric SMILES

CCCCCCCC1CCC(OC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCCC

InChI

InChI=1S/C31H46O/c1-3-5-7-9-11-13-26-15-18-28(19-16-26)29-20-22-30(23-21-29)31-24-17-27(25-32-31)14-12-10-8-6-4-2/h15-16,18-23,27,31H,3-14,17,24-25H2,1-2H3