methyl (2S,3S)-3-oxidanyl-2-prop-2-enyl-octanoate

Systemtic Name: methyl (2S,3S)-3-oxidanyl-2-prop-2-enyl-octanoate Openeye Name: methyl (2S,3S)-2-allyl-3-hydroxy-octanoate CAS Name: (2S,3S)-3-hydroxy-2-prop-2-enyloctanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-hydroxy-2-prop-2-enyloctanoate Traditional Name: (2S)-2-[(1S)-1-hydroxyhexyl]pent-4-enoic acid methyl ester Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CC=C)C(=O)OC)O

Isomeric SMILES

CCCCC[C@@H]([C@H](CC=C)C(=O)OC)O

InChI

InChI=1S/C12H22O3/c1-4-6-7-9-11(13)10(8-5-2)12(14)15-3/h5,10-11,13H,2,4,6-9H2,1,3H3/t10-,11-/m0/s1