2-(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-tert-butyl-5-methyl-2-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-(3-tert-butyl-2-hydroxy-5-methyl-phenyl)acetic acid CAS Name: 2-(3-tert-butyl-2-hydroxy-5-methylphenyl)acetic acid IUPAC Name: 2-(3-tert-butyl-2-hydroxy-5-methylphenyl)acetic acid Traditional Name: 2-(3-tert-butyl-2-hydroxy-5-methyl-phenyl)acetic acid Formula: C13H18O3 MolecularWeight: 222.28022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-8-5-9(7-11(14)15)12(16)10(6-8)13(2,3)4/h5-6,16H,7H2,1-4H3,(H,14,15)