heptyl 2-methyl-5-oxidanyl-hexanoate

Systemtic Name: heptyl 2-methyl-5-oxidanyl-hexanoate Openeye Name: heptyl 5-hydroxy-2-methyl-hexanoate CAS Name: 5-hydroxy-2-methylhexanoic acid heptyl ester IUPAC Name: heptyl 5-hydroxy-2-methylhexanoate Traditional Name: 5-hydroxy-2-methyl-hexanoic acid heptyl ester Formula: C14H28O3 MolecularWeight: 244.37032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(C)CCC(C)O

Isomeric SMILES

CCCCCCCOC(=O)C(C)CCC(C)O

InChI

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