(E,3S)-3-[(1S)-1-acetyloxyhexyl]dec-4-enoic acid

Systemtic Name: (E,3S)-3-[(1S)-1-acetyloxyhexyl]dec-4-enoic acid Openeye Name: (E,3S)-3-[(1S)-1-acetoxyhexyl]dec-4-enoic acid CAS Name: (E,3S)-3-[(1S)-1-acetyloxyhexyl]-4-decenoic acid IUPAC Name: (E,3S)-3-[(1S)-1-acetyloxyhexyl]dec-4-enoic acid Traditional Name: (E,3S)-3-[(1S)-1-acetoxyhexyl]dec-4-enoic acid Formula: C18H32O4 MolecularWeight: 312.44428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H32O4/c1-4-6-8-9-11-12-16(14-18(20)21)17(22-15(3)19)13-10-7-5-2/h11-12,16-17H,4-10,13-14H2,1-3H3,(H,20,21)/b12-11+/t16-,17+/m1/s1