2-(4-chlorophenyl)-2,5,5-trimethyl-1,3-dioxane

Systemtic Name: 2-(4-chlorophenyl)-2,5,5-trimethyl-1,3-dioxane Openeye Name: 2-(4-chlorophenyl)-2,5,5-trimethyl-1,3-dioxane CAS Name: 2-(4-chlorophenyl)-2,5,5-trimethyl-1,3-dioxane IUPAC Name: 2-(4-chlorophenyl)-2,5,5-trimethyl-1,3-dioxane Traditional Name: 2-(4-chlorophenyl)-2,5,5-trimethyl-1,3-dioxane Formula: C13H17ClO2 MolecularWeight: 240.72588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)(C)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1(COC(OC1)(C)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C13H17ClO2/c1-12(2)8-15-13(3,16-9-12)10-4-6-11(14)7-5-10/h4-7H,8-9H2,1-3H3