methyl (E,4S)-4-[(1R)-1-oxidanylpropyl]oct-2-enoate

Systemtic Name: methyl (E,4S)-4-[(1R)-1-oxidanylpropyl]oct-2-enoate Openeye Name: methyl (E,4S)-4-[(1R)-1-hydroxypropyl]oct-2-enoate CAS Name: (E,4S)-4-[(1R)-1-hydroxypropyl]-2-octenoic acid methyl ester IUPAC Name: methyl (E,4S)-4-[(1R)-1-hydroxypropyl]oct-2-enoate Traditional Name: (E,4S)-4-[(1R)-1-hydroxypropyl]oct-2-enoic acid methyl ester Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=CC(=O)OC)C(CC)O

Isomeric SMILES

CCCC[C@@H](/C=C/C(=O)OC)[C@@H](CC)O

InChI

InChI=1S/C12H22O3/c1-4-6-7-10(11(13)5-2)8-9-12(14)15-3/h8-11,13H,4-7H2,1-3H3/b9-8+/t10-,11+/m0/s1