2-phenyl-1,3-dioxane-5,5-dicarboxylic acid

Systemtic Name: 2-phenyl-1,3-dioxane-5,5-dicarboxylic acid Openeye Name: 2-phenyl-1,3-dioxane-5,5-dicarboxylic acid CAS Name: 2-phenyl-1,3-dioxane-5,5-dicarboxylic acid IUPAC Name: 2-phenyl-1,3-dioxane-5,5-dicarboxylic acid Traditional Name: 2-phenyl-1,3-dioxane-5,5-dicarboxylic acid Formula: C12H12O6 MolecularWeight: 252.22008

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(O1)C2=CC=CC=C2)(C(=O)O)C(=O)O

Isomeric SMILES

C1C(COC(O1)C2=CC=CC=C2)(C(=O)O)C(=O)O

InChI

InChI=1S/C12H12O6/c13-10(14)12(11(15)16)6-17-9(18-7-12)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,14)(H,15,16)