PH3
Summary
Name: | N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE |
Formula: | C7 H8 Cl N3 O |
Formal charge: | 0 |
Formula weight: | 185.611 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 1-(4-chlorophenyl)-3-hydroxyguanidine |
OpenEye OEToolkits | 1.5.0 | 1-(4-chlorophenyl)-3-hydroxy-guanidine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc1ccc(NC(=[N@H])NO)cc1 |
SMILES_CANONICAL | CACTVS | 3.341 | ONC(=N)Nc1ccc(Cl)cc1 |
SMILES | CACTVS | 3.341 | ONC(=N)Nc1ccc(Cl)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1NC(=N)NO)Cl |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1NC(=N)NO)Cl |
InChI | InChI | 1.03 | InChI=1S/C7H8ClN3O/c8-5-1-3-6(4-2-5)10-7(9)11-12/h1-4,12H,(H3,9,10,11) |
InChIKey | InChI | 1.03 | JYBXKTLYOMPMQY-UHFFFAOYSA-N |