ethyl 4-ethyl-2-methyl-3-oxidanyl-octanoate

Systemtic Name: ethyl 4-ethyl-2-methyl-3-oxidanyl-octanoate Openeye Name: ethyl 4-ethyl-3-hydroxy-2-methyl-octanoate CAS Name: 4-ethyl-3-hydroxy-2-methyloctanoic acid ethyl ester IUPAC Name: ethyl 4-ethyl-3-hydroxy-2-methyloctanoate Traditional Name: 4-ethyl-3-hydroxy-2-methyl-caprylic acid ethyl ester Formula: C13H26O3 MolecularWeight: 230.34374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(C(C)C(=O)OCC)O

Isomeric SMILES

CCCCC(CC)C(C(C)C(=O)OCC)O

InChI

InChI=1S/C13H26O3/c1-5-8-9-11(6-2)12(14)10(4)13(15)16-7-3/h10-12,14H,5-9H2,1-4H3