Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC=2C(=O)c1c(O)cc(cc1OC=2c3ccccc3O)O |
InChI | InChI | 1.03 | InChI=1S/C15H10O6/c16-7-5-10(18)12-11(6-7)21-15(14(20)13(12)19)8-3-1-2-4-9(8)17/h1-6,16-18,20H |
InChIKey | InChI | 1.03 | WCNLFPKXBGWWDS-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccccc3O)O |
SMILES | CACTVS | 3.385 | Oc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccccc3O)O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1ccc(c(c1)C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O |
SMILES | OpenEye OEToolkits | 2.0.4 | c1ccc(c(c1)C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O |