5-methyl-3-oxidanyl-3-phenyl-hexanoic acid

Systemtic Name: 5-methyl-3-oxidanyl-3-phenyl-hexanoic acid Openeye Name: 3-hydroxy-5-methyl-3-phenyl-hexanoic acid CAS Name: 3-hydroxy-5-methyl-3-phenylhexanoic acid IUPAC Name: 3-hydroxy-5-methyl-3-phenylhexanoic acid Traditional Name: 3-hydroxy-5-methyl-3-phenyl-hexanoic acid Formula: C13H18O3 MolecularWeight: 222.28022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)O)(C1=CC=CC=C1)O

Isomeric SMILES

CC(C)CC(CC(=O)O)(C1=CC=CC=C1)O

InChI

InChI=1S/C13H18O3/c1-10(2)8-13(16,9-12(14)15)11-6-4-3-5-7-11/h3-7,10,16H,8-9H2,1-2H3,(H,14,15)