AU8
Summary
| Name: | [3,5-bis(chloranyl)-4-phenyl-phenyl]methylazanium |
| Formula: | C13 H12 Cl2 N |
| Formal charge: | 1 |
| Formula weight: | 253.147 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [3,5-bis(chloranyl)-4-phenyl-phenyl]methylazanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H11Cl2N/c14-11-6-9(8-16)7-12(15)13(11)10-4-2-1-3-5-10/h1-7H,8,16H2/p+1 |
| InChIKey | InChI | 1.03 | CVRVMSHFNIYTSS-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | [NH3+]Cc1cc(Cl)c(c(Cl)c1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | [NH3+]Cc1cc(Cl)c(c(Cl)c1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)c2c(cc(cc2Cl)C[NH3+])Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)c2c(cc(cc2Cl)C[NH3+])Cl |
