(E,2R,3S)-2-methyl-3-[(1S)-1-propanoyloxyhexyl]dec-4-enoic acid

Systemtic Name: (E,2R,3S)-2-methyl-3-[(1S)-1-propanoyloxyhexyl]dec-4-enoic acid Openeye Name: (E,2R,3S)-2-methyl-3-[(1S)-1-propanoyloxyhexyl]dec-4-enoic acid CAS Name: (E,2R,3S)-2-methyl-3-[(1S)-1-(1-oxopropoxy)hexyl]-4-decenoic acid IUPAC Name: (E,2R,3S)-2-methyl-3-[(1S)-1-propanoyloxyhexyl]dec-4-enoic acid Traditional Name: (E,2R,3S)-2-methyl-3-[(1S)-1-propionyloxyhexyl]dec-4-enoic acid Formula: C20H36O4 MolecularWeight: 340.49744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H36O4/c1-5-8-10-11-13-14-17(16(4)20(22)23)18(15-12-9-6-2)24-19(21)7-3/h13-14,16-18H,5-12,15H2,1-4H3,(H,22,23)/b14-13+/t16-,17+,18+/m1/s1