2-(2,6-diethyl-4-methyl-phenyl)propanedioic acid

Systemtic Name: 2-(2,6-diethyl-4-methyl-phenyl)propanedioic acid Openeye Name: 2-(2,6-diethyl-4-methyl-phenyl)propanedioic acid CAS Name: 2-(2,6-diethyl-4-methylphenyl)propanedioic acid IUPAC Name: 2-(2,6-diethyl-4-methylphenyl)propanedioic acid Traditional Name: 2-(2,6-diethyl-4-methyl-phenyl)malonic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1C(C(=O)O)C(=O)O)CC)C

Isomeric SMILES

CCC1=CC(=CC(=C1C(C(=O)O)C(=O)O)CC)C

InChI

InChI=1S/C14H18O4/c1-4-9-6-8(3)7-10(5-2)11(9)12(13(15)16)14(17)18/h6-7,12H,4-5H2,1-3H3,(H,15,16)(H,17,18)