5-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-5-prop-2-ynyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-5-prop-2-ynyl-1,3-dioxane-4,6-dione Openeye Name: 5-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-5-prop-2-ynyl-1,3-dioxane-4,6-dione CAS Name: 5-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-5-prop-2-ynyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-5-prop-2-ynyl-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-propargyl-5-veratryl-1,3-dioxane-4,6-quinone Formula: C18H20O6 MolecularWeight: 332.3478

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CC#C)CC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(CC#C)CC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C18H20O6/c1-6-9-18(15(19)23-17(2,3)24-16(18)20)11-12-7-8-13(21-4)14(10-12)22-5/h1,7-8,10H,9,11H2,2-5H3