Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C1c3c(OC(=C1O)c2ccc(O)cc2)cc(O)cc3O |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2 |
SMILES | CACTVS | 3.341 | Oc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)cc3O2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H |
InChIKey | InChI | 1.03 | IYRMWMYZSQPJKC-UHFFFAOYSA-N |