I7Z
Summary
| Name: | 2-azanyl-4-chloranyl-benzenecarbonitrile |
| Formula: | C7 H5 Cl N2 |
| Formal charge: | 0 |
| Formula weight: | 152.581 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-azanyl-4-chloranyl-benzenecarbonitrile |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H5ClN2/c8-6-2-1-5(4-9)7(10)3-6/h1-3H,10H2 |
| InChIKey | InChI | 1.06 | UZHALXIAWJOLLR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cc(Cl)ccc1C#N |
| SMILES | CACTVS | 3.385 | Nc1cc(Cl)ccc1C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1Cl)N)C#N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1Cl)N)C#N |
