V5S
Summary
| Name: | 2-[(4-bromophenyl)amino]ethan-1-ol |
| Formula: | C8 H10 Br N O |
| Formal charge: | 0 |
| Formula weight: | 216.075 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-[(4-bromophenyl)amino]ethan-1-ol |
| OpenEye OEToolkits | 2.0.7 | 2-[(4-bromophenyl)amino]ethanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(CCO)c1ccc(Br)cc1 |
| InChI | InChI | 1.03 | InChI=1S/C8H10BrNO/c9-7-1-3-8(4-2-7)10-5-6-11/h1-4,10-11H,5-6H2 |
| InChIKey | InChI | 1.03 | GYWMAZOWKOVMKS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCCNc1ccc(Br)cc1 |
| SMILES | CACTVS | 3.385 | OCCNc1ccc(Br)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1NCCO)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1NCCO)Br |
