SQ7
Summary
Name: | 3-(4-chlorophenyl)imidazole-2,4-dione |
Formula: | C9 H5 Cl N2 O2 |
Formal charge: | 0 |
Formula weight: | 208.601 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 3-(4-chlorophenyl)imidazole-2,4-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H5ClN2O2/c10-6-1-3-7(4-2-6)12-8(13)5-11-9(12)14/h1-5H |
InChIKey | InChI | 1.03 | NBCHVOUDLBVSEK-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(cc1)N2C(=O)C=NC2=O |
SMILES | CACTVS | 3.385 | Clc1ccc(cc1)N2C(=O)C=NC2=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1N2C(=O)C=NC2=O)Cl |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1N2C(=O)C=NC2=O)Cl |