2-oxidanyl-2-(2-pentan-2-ylphenyl)ethanoate

Systemtic Name: 2-oxidanyl-2-(2-pentan-2-ylphenyl)ethanoate Openeye Name: 2-hydroxy-2-[2-(1-methylbutyl)phenyl]acetate CAS Name: 2-hydroxy-2-(2-pentan-2-ylphenyl)acetate IUPAC Name: 2-hydroxy-2-(2-pentan-2-ylphenyl)acetate Traditional Name: 2-hydroxy-2-[2-(1-methylbutyl)phenyl]acetate Formula: C13H17O3- MolecularWeight: 221.27228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC=CC=C1C(C(=O)[O-])O

Isomeric SMILES

CCCC(C)C1=CC=CC=C1C(C(=O)[O-])O

InChI

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