FB4
Summary
Name: | 2-(2-amino-4-chlorophenoxy)-5-chlorophenol |
Formula: | C12 H9 Cl2 N O2 |
Formal charge: | 0 |
Formula weight: | 270.111 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.6.1 | 2-(2-azanyl-4-chloro-phenoxy)-5-chloro-phenol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | Nc1cc(Cl)ccc1Oc2ccc(Cl)cc2O |
SMILES | CACTVS | 3.352 | Nc1cc(Cl)ccc1Oc2ccc(Cl)cc2O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(c(cc1Cl)N)Oc2ccc(cc2O)Cl |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(c(cc1Cl)N)Oc2ccc(cc2O)Cl |
InChI | InChI | 1.03 | InChI=1S/C12H9Cl2NO2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H,15H2 |
InChIKey | InChI | 1.03 | ZNHVVJUATLQYST-UHFFFAOYSA-N |