5-methyl-2-phenyl-1,3-dioxane-5-carboxylate

Systemtic Name: 5-methyl-2-phenyl-1,3-dioxane-5-carboxylate Openeye Name: 5-methyl-2-phenyl-1,3-dioxane-5-carboxylate CAS Name: 5-methyl-2-phenyl-1,3-dioxane-5-carboxylate IUPAC Name: 5-methyl-2-phenyl-1,3-dioxane-5-carboxylate Traditional Name: 5-methyl-2-phenyl-1,3-dioxane-5-carboxylate Formula: C12H13O4- MolecularWeight: 221.22922

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1(COC(OC1)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C12H14O4/c1-12(11(13)14)7-15-10(16-8-12)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,14)/p-1