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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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