ethyl 3-ethyl-2-methyl-3-oxidanyl-nonanoate

Systemtic Name: ethyl 3-ethyl-2-methyl-3-oxidanyl-nonanoate Openeye Name: ethyl 3-ethyl-3-hydroxy-2-methyl-nonanoate CAS Name: 3-ethyl-3-hydroxy-2-methylnonanoic acid ethyl ester IUPAC Name: ethyl 3-ethyl-3-hydroxy-2-methylnonanoate Traditional Name: 3-ethyl-3-hydroxy-2-methyl-pelargonic acid ethyl ester Formula: C14H28O3 MolecularWeight: 244.37032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)(C(C)C(=O)OCC)O

Isomeric SMILES

CCCCCCC(CC)(C(C)C(=O)OCC)O

InChI

InChI=1S/C14H28O3/c1-5-8-9-10-11-14(16,6-2)12(4)13(15)17-7-3/h12,16H,5-11H2,1-4H3