2-(4-chloranylbutyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane

Systemtic Name: 2-(4-chloranylbutyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane Openeye Name: 2-(4-chlorobutyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane CAS Name: 2-(4-chlorobutyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane IUPAC Name: 2-(4-chlorobutyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane Traditional Name: 2-(4-chlorobutyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane Formula: C17H25ClO3 MolecularWeight: 312.8316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)(CCCCCl)C2=CC=C(C=C2)OC)C

Isomeric SMILES

CC1(COC(OC1)(CCCCCl)C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C17H25ClO3/c1-16(2)12-20-17(21-13-16,10-4-5-11-18)14-6-8-15(19-3)9-7-14/h6-9H,4-5,10-13H2,1-3H3