A1CWH
Summary
| Name: | 4-(2-methyl-1H-imidazol-1-yl)aniline |
| Formula: | C10 H11 N3 |
| Formal charge: | 0 |
| Formula weight: | 173.214 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 4-(2-methyl-1H-imidazol-1-yl)aniline |
| OpenEye OEToolkits | 3.1.0.0 | 4-(2-methylimidazol-1-yl)aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Nc1ccc(cc1)n1ccnc1C |
| InChI | InChI | 1.06 | InChI=1S/C10H11N3/c1-8-12-6-7-13(8)10-4-2-9(11)3-5-10/h2-7H,11H2,1H3 |
| InChIKey | InChI | 1.06 | IEZCMVRWKNEHJB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nccn1c2ccc(N)cc2 |
| SMILES | CACTVS | 3.385 | Cc1nccn1c2ccc(N)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1nccn1c2ccc(cc2)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1nccn1c2ccc(cc2)N |
