2-(2-tert-butylphenyl)propanedioic acid

Systemtic Name: 2-(2-tert-butylphenyl)propanedioic acid Openeye Name: 2-(2-tert-butylphenyl)propanedioic acid CAS Name: 2-(2-tert-butylphenyl)propanedioic acid IUPAC Name: 2-(2-tert-butylphenyl)propanedioic acid Traditional Name: 2-(2-tert-butylphenyl)malonic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1C(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H16O4/c1-13(2,3)9-7-5-4-6-8(9)10(11(14)15)12(16)17/h4-7,10H,1-3H3,(H,14,15)(H,16,17)