5-[2-(3,4-dimethoxyphenyl)ethyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-homoveratryl-2,2,5-trimethyl-1,3-dioxane-4,6-quinone Formula: C17H22O6 MolecularWeight: 322.35298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(C)CCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(C)CCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C17H22O6/c1-16(2)22-14(18)17(3,15(19)23-16)9-8-11-6-7-12(20-4)13(10-11)21-5/h6-7,10H,8-9H2,1-5H3