2,2-dimethyl-5-(1-phenylethyl)-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-(1-phenylethyl)-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-(1-phenylethyl)-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-(1-phenylethyl)-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-(1-phenylethyl)-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-(1-phenylethyl)-1,3-dioxane-4,6-quinone Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)OC(OC1=O)(C)C)C2=CC=CC=C2

Isomeric SMILES

CC(C1C(=O)OC(OC1=O)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C14H16O4/c1-9(10-7-5-4-6-8-10)11-12(15)17-14(2,3)18-13(11)16/h4-9,11H,1-3H3