BB4
Summary
| Name: | 2-(5-bromo-1H-indol-3-yl)-N-hydroxyacetamide |
| Formula: | C10 H9 Br N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 269.095 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(5-bromo-1H-indol-3-yl)-N-hydroxyacetamide |
| OpenEye OEToolkits | 1.7.0 | 2-(5-bromo-1H-indol-3-yl)-N-hydroxy-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Brc1cc2c(cc1)ncc2CC(=O)NO |
| SMILES_CANONICAL | CACTVS | 3.370 | ONC(=O)Cc1c[nH]c2ccc(Br)cc12 |
| SMILES | CACTVS | 3.370 | ONC(=O)Cc1c[nH]c2ccc(Br)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc2c(cc1Br)c(c[nH]2)CC(=O)NO |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc2c(cc1Br)c(c[nH]2)CC(=O)NO |
| InChI | InChI | 1.03 | InChI=1S/C10H9BrN2O2/c11-7-1-2-9-8(4-7)6(5-12-9)3-10(14)13-15/h1-2,4-5,12,15H,3H2,(H,13,14) |
| InChIKey | InChI | 1.03 | ZDQORGWUODGWFT-UHFFFAOYSA-N |
