2-[3-(4-tert-butylphenyl)propyl]propanedioic acid

Systemtic Name: 2-[3-(4-tert-butylphenyl)propyl]propanedioic acid Openeye Name: 2-[3-(4-tert-butylphenyl)propyl]propanedioic acid CAS Name: 2-[3-(4-tert-butylphenyl)propyl]propanedioic acid IUPAC Name: 2-[3-(4-tert-butylphenyl)propyl]propanedioic acid Traditional Name: 2-[3-(4-tert-butylphenyl)propyl]malonic acid Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCCC(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCCC(C(=O)O)C(=O)O

InChI

InChI=1S/C16H22O4/c1-16(2,3)12-9-7-11(8-10-12)5-4-6-13(14(17)18)15(19)20/h7-10,13H,4-6H2,1-3H3,(H,17,18)(H,19,20)