(2-ethyl-3-oxidanyl-hexyl) butanoate

Systemtic Name: (2-ethyl-3-oxidanyl-hexyl) butanoate Openeye Name: (2-ethyl-3-hydroxy-hexyl) butanoate CAS Name: butanoic acid (2-ethyl-3-hydroxyhexyl) ester IUPAC Name: (2-ethyl-3-hydroxyhexyl) butanoate Traditional Name: butyric acid (2-ethyl-3-hydroxy-hexyl) ester Formula: C12H24O3 MolecularWeight: 216.31716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)COC(=O)CCC)O

Isomeric SMILES

CCCC(C(CC)COC(=O)CCC)O

InChI

InChI=1S/C12H24O3/c1-4-7-11(13)10(6-3)9-15-12(14)8-5-2/h10-11,13H,4-9H2,1-3H3