(4R)-4-oxidanyl-4-(2,4,6-trimethylphenyl)butanoate

Systemtic Name: (4R)-4-oxidanyl-4-(2,4,6-trimethylphenyl)butanoate Openeye Name: (4R)-4-hydroxy-4-(2,4,6-trimethylphenyl)butanoate CAS Name: (4R)-4-hydroxy-4-(2,4,6-trimethylphenyl)butanoate IUPAC Name: (4R)-4-hydroxy-4-(2,4,6-trimethylphenyl)butanoate Traditional Name: (4R)-4-hydroxy-4-mesityl-butyrate Formula: C13H17O3- MolecularWeight: 221.27228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)[C@@H](CCC(=O)[O-])O)C

InChI

InChI=1S/C13H18O3/c1-8-6-9(2)13(10(3)7-8)11(14)4-5-12(15)16/h6-7,11,14H,4-5H2,1-3H3,(H,15,16)/p-1/t11-/m1/s1