Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1cc(OC)c2c(n1)ccc(c2)N(c3c(Cl)cccc3Cl)C |
InChI | InChI | 1.03 | InChI=1S/C17H14Cl2N2O/c1-21(17-13(18)4-3-5-14(17)19)11-6-7-15-12(10-11)16(22-2)8-9-20-15/h3-10H,1-2H3 |
InChIKey | InChI | 1.03 | IQXIXPLQQDFASE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccnc2ccc(cc12)N(C)c3c(Cl)cccc3Cl |
SMILES | CACTVS | 3.385 | COc1ccnc2ccc(cc12)N(C)c3c(Cl)cccc3Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN(c1ccc2c(c1)c(ccn2)OC)c3c(cccc3Cl)Cl |
SMILES | OpenEye OEToolkits | 1.9.2 | CN(c1ccc2c(c1)c(ccn2)OC)c3c(cccc3Cl)Cl |