ethyl 2,2-dimethyl-3-oxidanyl-3-propyl-hexanoate

Systemtic Name: ethyl 2,2-dimethyl-3-oxidanyl-3-propyl-hexanoate Openeye Name: ethyl 3-hydroxy-2,2-dimethyl-3-propyl-hexanoate CAS Name: 3-hydroxy-2,2-dimethyl-3-propylhexanoic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-2,2-dimethyl-3-propylhexanoate Traditional Name: 3-hydroxy-2,2-dimethyl-3-propyl-hexanoic acid ethyl ester Formula: C13H26O3 MolecularWeight: 230.34374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C(C)(C)C(=O)OCC)O

Isomeric SMILES

CCCC(CCC)(C(C)(C)C(=O)OCC)O

InChI

InChI=1S/C13H26O3/c1-6-9-13(15,10-7-2)12(4,5)11(14)16-8-3/h15H,6-10H2,1-5H3