2-[2-(2-methylphenyl)ethyl]propanedioic acid

Systemtic Name: 2-[2-(2-methylphenyl)ethyl]propanedioic acid Openeye Name: 2-[2-(o-tolyl)ethyl]propanedioic acid CAS Name: 2-[2-(2-methylphenyl)ethyl]propanedioic acid IUPAC Name: 2-[2-(2-methylphenyl)ethyl]propanedioic acid Traditional Name: 2-[2-(o-tolyl)ethyl]malonic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CCC(C(=O)O)C(=O)O

InChI

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