5-heptyl-5-methyl-2-(4-propylphenyl)-1,3-dioxane

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(COC(OC1)C2=CC=C(C=C2)CCC)C

Isomeric SMILES

CCCCCCCC1(COC(OC1)C2=CC=C(C=C2)CCC)C

InChI

InChI=1S/C21H34O2/c1-4-6-7-8-9-15-21(3)16-22-20(23-17-21)19-13-11-18(10-5-2)12-14-19/h11-14,20H,4-10,15-17H2,1-3H3