2-butyl-5-[4-(4-propylphenyl)butyl]-1,3-dioxane

Systemtic Name: 2-butyl-5-[4-(4-propylphenyl)butyl]-1,3-dioxane Openeye Name: 2-butyl-5-[4-(4-propylphenyl)butyl]-1,3-dioxane CAS Name: 2-butyl-5-[4-(4-propylphenyl)butyl]-1,3-dioxane IUPAC Name: 2-butyl-5-[4-(4-propylphenyl)butyl]-1,3-dioxane Traditional Name: 2-butyl-5-[4-(4-propylphenyl)butyl]-1,3-dioxane Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1OCC(CO1)CCCCC2=CC=C(C=C2)CCC

Isomeric SMILES

CCCCC1OCC(CO1)CCCCC2=CC=C(C=C2)CCC

InChI

InChI=1S/C21H34O2/c1-3-5-11-21-22-16-20(17-23-21)10-7-6-9-19-14-12-18(8-4-2)13-15-19/h12-15,20-21H,3-11,16-17H2,1-2H3