hexyl 3-methyl-4-oxidanyl-pentanoate

Systemtic Name: hexyl 3-methyl-4-oxidanyl-pentanoate Openeye Name: hexyl 4-hydroxy-3-methyl-pentanoate CAS Name: 4-hydroxy-3-methylpentanoic acid hexyl ester IUPAC Name: hexyl 4-hydroxy-3-methylpentanoate Traditional Name: 4-hydroxy-3-methyl-valeric acid hexyl ester Formula: C12H24O3 MolecularWeight: 216.31716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(C)C(C)O

Isomeric SMILES

CCCCCCOC(=O)CC(C)C(C)O

InChI

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