3-(3-tert-butyl-2-oxidanyl-phenyl)propanoic acid

Systemtic Name: 3-(3-tert-butyl-2-oxidanyl-phenyl)propanoic acid Openeye Name: 3-(3-tert-butyl-2-hydroxy-phenyl)propanoic acid CAS Name: 3-(3-tert-butyl-2-hydroxyphenyl)propanoic acid IUPAC Name: 3-(3-tert-butyl-2-hydroxyphenyl)propanoic acid Traditional Name: 3-(3-tert-butyl-2-hydroxy-phenyl)propionic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=C1O)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC(=C1O)CCC(=O)O

InChI

InChI=1S/C13H18O3/c1-13(2,3)10-6-4-5-9(12(10)16)7-8-11(14)15/h4-6,16H,7-8H2,1-3H3,(H,14,15)