Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1cc(Oc2ccccc2)c(cc1)c1cc(CC(=O)O)ccc1 |
InChI | InChI | 1.06 | InChI=1S/C20H15ClO3/c21-16-9-10-18(15-6-4-5-14(11-15)12-20(22)23)19(13-16)24-17-7-2-1-3-8-17/h1-11,13H,12H2,(H,22,23) |
InChIKey | InChI | 1.06 | LVZMPQWPNLPPJY-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)Cc1cccc(c1)c2ccc(Cl)cc2Oc3ccccc3 |
SMILES | CACTVS | 3.385 | OC(=O)Cc1cccc(c1)c2ccc(Cl)cc2Oc3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2cc(ccc2c3cccc(c3)CC(=O)O)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2cc(ccc2c3cccc(c3)CC(=O)O)Cl |