heptan-2-yl hex-5-enoate

Systemtic Name: heptan-2-yl hex-5-enoate Openeye Name: 1-methylhexyl hex-5-enoate CAS Name: 5-hexenoic acid heptan-2-yl ester IUPAC Name: heptan-2-yl hex-5-enoate Traditional Name: hex-5-enoic acid 1-methylhexyl ester Formula: C13H24O2 MolecularWeight: 212.32846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC(=O)CCCC=C

Isomeric SMILES

CCCCCC(C)OC(=O)CCCC=C

InChI

InChI=1S/C13H24O2/c1-4-6-8-10-12(3)15-13(14)11-9-7-5-2/h5,12H,2,4,6-11H2,1,3H3