2-(2-tert-butyl-5-methyl-phenoxy)ethanoate

Systemtic Name: 2-(2-tert-butyl-5-methyl-phenoxy)ethanoate Openeye Name: 2-(2-tert-butyl-5-methyl-phenoxy)acetate CAS Name: 2-(2-tert-butyl-5-methylphenoxy)acetate IUPAC Name: 2-(2-tert-butyl-5-methylphenoxy)acetate Traditional Name: 2-(2-tert-butyl-5-methyl-phenoxy)acetate Formula: C13H17O3- MolecularWeight: 221.27228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCC(=O)[O-]

InChI

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