(6aR,10aR)-9-iodanyl-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol

Systemtic Name: (6aR,10aR)-9-iodanyl-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol Openeye Name: (6aR,10aR)-9-iodo-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol CAS Name: (6aR,10aR)-9-iodo-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c][1]benzopyran-1-ol IUPAC Name: (6aR,10aR)-9-iodo-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol Traditional Name: (6aR,10aR)-3-amyl-9-iodo-6,6-dimethyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol Formula: C20H27IO2 MolecularWeight: 426.33165

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C3CC(=CCC3C(O2)(C)C)I)C(=C1)O

Isomeric SMILES

CCCCCC1=CC2=C([C@@H]3CC(=CC[C@H]3C(O2)(C)C)I)C(=C1)O

InChI

InChI=1S/C20H27IO2/c1-4-5-6-7-13-10-17(22)19-15-12-14(21)8-9-16(15)20(2,3)23-18(19)11-13/h8,10-11,15-16,22H,4-7,9,12H2,1-3H3/t15-,16-/m1/s1