2-(4-butylphenyl)-2-oxidanyl-propanoic acid

Systemtic Name: 2-(4-butylphenyl)-2-oxidanyl-propanoic acid Openeye Name: 2-(4-butylphenyl)-2-hydroxy-propanoic acid CAS Name: 2-(4-butylphenyl)-2-hydroxypropanoic acid IUPAC Name: 2-(4-butylphenyl)-2-hydroxypropanoic acid Traditional Name: 2-(4-butylphenyl)-2-hydroxy-propionic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C)(C(=O)O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(C)(C(=O)O)O

InChI

InChI=1S/C13H18O3/c1-3-4-5-10-6-8-11(9-7-10)13(2,16)12(14)15/h6-9,16H,3-5H2,1-2H3,(H,14,15)