(2S,4R,5R)-5-(phenylmethyl)undecane-2,4-diol

Systemtic Name: (2S,4R,5R)-5-(phenylmethyl)undecane-2,4-diol Openeye Name: (2S,4R,5R)-5-benzylundecane-2,4-diol CAS Name: (2S,4R,5R)-5-(phenylmethyl)undecane-2,4-diol IUPAC Name: (2S,4R,5R)-5-benzylundecane-2,4-diol Traditional Name: (2S,4R,5R)-5-benzylundecane-2,4-diol Formula: C18H30O2 MolecularWeight: 278.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC1=CC=CC=C1)C(CC(C)O)O

Isomeric SMILES

CCCCCC[C@H](CC1=CC=CC=C1)[C@@H](C[C@H](C)O)O

InChI

InChI=1S/C18H30O2/c1-3-4-5-9-12-17(18(20)13-15(2)19)14-16-10-7-6-8-11-16/h6-8,10-11,15,17-20H,3-5,9,12-14H2,1-2H3/t15-,17+,18+/m0/s1