3-(4-ethylphenyl)-3-methyl-butanoate

Systemtic Name: 3-(4-ethylphenyl)-3-methyl-butanoate Openeye Name: 3-(4-ethylphenyl)-3-methyl-butanoate CAS Name: 3-(4-ethylphenyl)-3-methylbutanoate IUPAC Name: 3-(4-ethylphenyl)-3-methylbutanoate Traditional Name: 3-(4-ethylphenyl)-3-methyl-butyrate Formula: C13H17O2- MolecularWeight: 205.27288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)(C)CC(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)(C)CC(=O)[O-]

InChI

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