Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc3ccc(Oc1ccc(cc1O)Cc2ncccc2)c(Cl)c3 |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1cc(Cc2ccccn2)ccc1Oc3ccc(Cl)cc3Cl |
SMILES | CACTVS | 3.341 | Oc1cc(Cc2ccccn2)ccc1Oc3ccc(Cl)cc3Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccnc(c1)Cc2ccc(c(c2)O)Oc3ccc(cc3Cl)Cl |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccnc(c1)Cc2ccc(c(c2)O)Oc3ccc(cc3Cl)Cl |
InChI | InChI | 1.03 | InChI=1S/C18H13Cl2NO2/c19-13-5-7-17(15(20)11-13)23-18-6-4-12(10-16(18)22)9-14-3-1-2-8-21-14/h1-8,10-11,22H,9H2 |
InChIKey | InChI | 1.03 | AOVDSWPGWPRTSR-UHFFFAOYSA-N |