Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(Oc1ccc(cc1)c2ccccc2C(C)C)Cc3ccccc3 |
InChI | InChI | 1.03 | InChI=1S/C24H24O3/c1-17(2)21-10-6-7-11-22(21)19-12-14-20(15-13-19)27-23(24(25)26)16-18-8-4-3-5-9-18/h3-15,17,23H,16H2,1-2H3,(H,25,26)/t23-/m0/s1 |
InChIKey | InChI | 1.03 | LGZFNUULAZCXCA-QHCPKHFHSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CC(C)c1ccccc1c2ccc(O[C@@H](Cc3ccccc3)C(O)=O)cc2 |
SMILES | CACTVS | 3.370 | CC(C)c1ccccc1c2ccc(O[CH](Cc3ccccc3)C(O)=O)cc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(C)c1ccccc1c2ccc(cc2)O[C@@H](Cc3ccccc3)C(=O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)c1ccccc1c2ccc(cc2)OC(Cc3ccccc3)C(=O)O |