3-methyl-6-(phenylmethyl)-1,4-dioxane-2,5-dione

Systemtic Name: 3-methyl-6-(phenylmethyl)-1,4-dioxane-2,5-dione Openeye Name: 3-benzyl-6-methyl-1,4-dioxane-2,5-dione CAS Name: 3-methyl-6-(phenylmethyl)-1,4-dioxane-2,5-dione IUPAC Name: 3-benzyl-6-methyl-1,4-dioxane-2,5-dione Traditional Name: 3-benzyl-6-methyl-1,4-dioxane-2,5-quinone Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)OC(C(=O)O1)CC2=CC=CC=C2

Isomeric SMILES

CC1C(=O)OC(C(=O)O1)CC2=CC=CC=C2

InChI

InChI=1S/C12H12O4/c1-8-11(13)16-10(12(14)15-8)7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3