(E)-8-[(2R,3S)-3-octyloxiran-2-yl]oct-2-enoic acid

Systemtic Name: (E)-8-[(2R,3S)-3-octyloxiran-2-yl]oct-2-enoic acid Openeye Name: (E)-8-[(2R,3S)-3-octyloxiran-2-yl]oct-2-enoic acid CAS Name: (E)-8-[(2R,3S)-3-octyl-2-oxiranyl]-2-octenoic acid IUPAC Name: (E)-8-[(2R,3S)-3-octyloxiran-2-yl]oct-2-enoic acid Traditional Name: (E)-8-[(2R,3S)-3-octyloxiran-2-yl]oct-2-enoic acid Formula: C18H32O3 MolecularWeight: 296.44488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(O1)CCCCCC=CC(=O)O

Isomeric SMILES

CCCCCCCC[C@H]1[C@H](O1)CCCCC/C=C/C(=O)O

InChI

InChI=1S/C18H32O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h12,15-17H,2-11,13-14H2,1H3,(H,19,20)/b15-12+/t16-,17+/m0/s1