(3R,5S)-5-phenylmethoxyhexadecane-1,3-diol

Systemtic Name: (3R,5S)-5-phenylmethoxyhexadecane-1,3-diol Openeye Name: (3R,5S)-5-benzyloxyhexadecane-1,3-diol CAS Name: (3R,5S)-5-phenylmethoxyhexadecane-1,3-diol IUPAC Name: (3R,5S)-5-phenylmethoxyhexadecane-1,3-diol Traditional Name: (3R,5S)-5-benzoxyhexadecane-1,3-diol Formula: C23H40O3 MolecularWeight: 364.5619

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(CCO)O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCC[C@@H](C[C@@H](CCO)O)OCC1=CC=CC=C1

InChI

InChI=1S/C23H40O3/c1-2-3-4-5-6-7-8-9-13-16-23(19-22(25)17-18-24)26-20-21-14-11-10-12-15-21/h10-12,14-15,22-25H,2-9,13,16-20H2,1H3/t22-,23+/m1/s1