2-[2-(methanoyloxymethyl)-4-methyl-phenyl]propanedioic acid

Systemtic Name: 2-[2-(methanoyloxymethyl)-4-methyl-phenyl]propanedioic acid Openeye Name: 2-[2-(formyloxymethyl)-4-methyl-phenyl]propanedioic acid CAS Name: 2-[2-(formyloxymethyl)-4-methylphenyl]propanedioic acid IUPAC Name: 2-[2-(formyloxymethyl)-4-methylphenyl]propanedioic acid Traditional Name: 2-[2-(formyloxymethyl)-4-methyl-phenyl]malonic acid Formula: C12H12O6 MolecularWeight: 252.22008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C(=O)O)C(=O)O)COC=O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C(=O)O)C(=O)O)COC=O

InChI

InChI=1S/C12H12O6/c1-7-2-3-9(8(4-7)5-18-6-13)10(11(14)15)12(16)17/h2-4,6,10H,5H2,1H3,(H,14,15)(H,16,17)