(E,2R,3R)-2-phenylmethoxyoctadec-4-ene-1,3-diol

Systemtic Name: (E,2R,3R)-2-phenylmethoxyoctadec-4-ene-1,3-diol Openeye Name: (E,2R,3R)-2-benzyloxyoctadec-4-ene-1,3-diol CAS Name: (E,2R,3R)-2-phenylmethoxy-4-octadecene-1,3-diol IUPAC Name: (E,2R,3R)-2-phenylmethoxyoctadec-4-ene-1,3-diol Traditional Name: (E,2R,3R)-2-benzoxyoctadec-4-ene-1,3-diol Formula: C25H42O3 MolecularWeight: 390.59918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CO)OCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@H]([C@@H](CO)OCC1=CC=CC=C1)O

InChI

InChI=1S/C25H42O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-24(27)25(21-26)28-22-23-18-15-14-16-19-23/h14-20,24-27H,2-13,21-22H2,1H3/b20-17+/t24-,25-/m1/s1