ELN
Summary
| Name: | ~{N}-(4-chlorophenyl)-2-cyano-ethanamide |
| Formula: | C9 H7 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 194.618 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(4-chlorophenyl)-2-cyano-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H7ClN2O/c10-7-1-3-8(4-2-7)12-9(13)5-6-11/h1-4H,5H2,(H,12,13) |
| InChIKey | InChI | 1.03 | FLLVVAHFEBGZKD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(NC(=O)CC#N)cc1 |
| SMILES | CACTVS | 3.385 | Clc1ccc(NC(=O)CC#N)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1NC(=O)CC#N)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1NC(=O)CC#N)Cl |
