Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Oc1ccc(cc1O)CC(C)C(C)Cc2ccc(O)c(O)c2 |
InChI | InChI | 1.03 | InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3/t11-,12-/m0/s1 |
InChIKey | InChI | 1.03 | HCZKYJDFEPMADG-RYUDHWBXSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](Cc1ccc(O)c(O)c1)[C@@H](C)Cc2ccc(O)c(O)c2 |
SMILES | CACTVS | 3.385 | C[CH](Cc1ccc(O)c(O)c1)[CH](C)Cc2ccc(O)c(O)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C[C@@H](Cc1ccc(c(c1)O)O)[C@@H](C)Cc2ccc(c(c2)O)O |
SMILES | OpenEye OEToolkits | 1.9.2 | CC(Cc1ccc(c(c1)O)O)C(C)Cc2ccc(c(c2)O)O |