ethyl 2-butyl-3-methyl-3-oxidanyl-dodecanoate

Systemtic Name: ethyl 2-butyl-3-methyl-3-oxidanyl-dodecanoate Openeye Name: ethyl 2-butyl-3-hydroxy-3-methyl-dodecanoate CAS Name: 2-butyl-3-hydroxy-3-methyldodecanoic acid ethyl ester IUPAC Name: ethyl 2-butyl-3-hydroxy-3-methyldodecanoate Traditional Name: 2-butyl-3-hydroxy-3-methyl-lauric acid ethyl ester Formula: C19H38O3 MolecularWeight: 314.50322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(C(CCCC)C(=O)OCC)O

Isomeric SMILES

CCCCCCCCCC(C)(C(CCCC)C(=O)OCC)O

InChI

InChI=1S/C19H38O3/c1-5-8-10-11-12-13-14-16-19(4,21)17(15-9-6-2)18(20)22-7-3/h17,21H,5-16H2,1-4H3