5-oxabicyclo[2.2.1]hept-2-en-4-yl 2-methyloctanoate

Systemtic Name: 5-oxabicyclo[2.2.1]hept-2-en-4-yl 2-methyloctanoate Openeye Name: 5-oxabicyclo[2.2.1]hept-2-en-4-yl 2-methyloctanoate CAS Name: 2-methyloctanoic acid 5-oxabicyclo[2.2.1]hept-2-en-4-yl ester IUPAC Name: 5-oxabicyclo[2.2.1]hept-2-en-4-yl 2-methyloctanoate Traditional Name: 2-methylcaprylic acid 5-oxabicyclo[2.2.1]hept-2-en-4-yl ester Formula: C15H24O3 MolecularWeight: 252.34926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(=O)OC12CC(CO1)C=C2

Isomeric SMILES

CCCCCCC(C)C(=O)OC12CC(CO1)C=C2

InChI

InChI=1S/C15H24O3/c1-3-4-5-6-7-12(2)14(16)18-15-9-8-13(10-15)11-17-15/h8-9,12-13H,3-7,10-11H2,1-2H3