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

Systemtic Name: 2-(5-tert-butyl-2-methyl-phenyl)ethanoate Openeye Name: 2-(5-tert-butyl-2-methyl-phenyl)acetate CAS Name: 2-(5-tert-butyl-2-methylphenyl)acetate IUPAC Name: 2-(5-tert-butyl-2-methylphenyl)acetate Traditional Name: 2-(5-tert-butyl-2-methyl-phenyl)acetate Formula: C13H17O2- MolecularWeight: 205.27288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2/c1-9-5-6-11(13(2,3)4)7-10(9)8-12(14)15/h5-7H,8H2,1-4H3,(H,14,15)/p-1