(1S,2R,5S,6R)-5,6-bis(methoxymethyl)-3-propan-2-yl-cyclohex-3-ene-1,2-diol

Systemtic Name: (1S,2R,5S,6R)-5,6-bis(methoxymethyl)-3-propan-2-yl-cyclohex-3-ene-1,2-diol Openeye Name: (1S,2R,5S,6R)-3-isopropyl-5,6-bis(methoxymethyl)cyclohex-3-ene-1,2-diol CAS Name: (1S,2R,5S,6R)-5,6-bis(methoxymethyl)-3-propan-2-ylcyclohex-3-ene-1,2-diol IUPAC Name: (1S,2R,5S,6R)-5,6-bis(methoxymethyl)-3-propan-2-ylcyclohex-3-ene-1,2-diol Traditional Name: (1S,2R,5S,6R)-3-isopropyl-5,6-bis(methoxymethyl)cyclohex-3-ene-1,2-diol Formula: C13H24O4 MolecularWeight: 244.32726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(C(C(C1O)O)COC)COC

Isomeric SMILES

CC(C)C1=C[C@@H]([C@@H]([C@@H]([C@@H]1O)O)COC)COC

InChI

InChI=1S/C13H24O4/c1-8(2)10-5-9(6-16-3)11(7-17-4)13(15)12(10)14/h5,8-9,11-15H,6-7H2,1-4H3/t9-,11+,12-,13+/m1/s1