2-(4-butylphenyl)-4-heptyl-1,3-dioxane

Systemtic Name: 2-(4-butylphenyl)-4-heptyl-1,3-dioxane Openeye Name: 2-(4-butylphenyl)-4-heptyl-1,3-dioxane CAS Name: 2-(4-butylphenyl)-4-heptyl-1,3-dioxane IUPAC Name: 2-(4-butylphenyl)-4-heptyl-1,3-dioxane Traditional Name: 2-(4-butylphenyl)-4-heptyl-1,3-dioxane Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCOC(O1)C2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCCCC1CCOC(O1)C2=CC=C(C=C2)CCCC

InChI

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