Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1c(cccc1)\N=C(\c2ccc(O)cc2)c3ccc(cc3)O |
InChI | InChI | 1.03 | InChI=1S/C19H14ClNO2/c20-17-3-1-2-4-18(17)21-19(13-5-9-15(22)10-6-13)14-7-11-16(23)12-8-14/h1-12,22-23H |
InChIKey | InChI | 1.03 | KCIOZMOTULBIRT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(cc1)C(=Nc2ccccc2Cl)c3ccc(O)cc3 |
SMILES | CACTVS | 3.385 | Oc1ccc(cc1)C(=Nc2ccccc2Cl)c3ccc(O)cc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc(c(c1)N=C(c2ccc(cc2)O)c3ccc(cc3)O)Cl |
SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(c(c1)N=C(c2ccc(cc2)O)c3ccc(cc3)O)Cl |