ZHW
Summary
| Name: | (1R)-1-amino-2,3-dihydro-1H-inden-4-yl sulfurofluoridate |
| Formula: | C9 H10 F N O3 S |
| Formal charge: | 0 |
| Formula weight: | 231.244 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R)-1-amino-2,3-dihydro-1H-inden-4-yl sulfurofluoridate |
| OpenEye OEToolkits | 2.0.7 | (1~{R})-1-azanyl-4-fluorosulfonyloxy-2,3-dihydro-1~{H}-indene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | FS(=O)(=O)Oc1cccc2c1CCC2N |
| InChI | InChI | 1.06 | InChI=1S/C9H10FNO3S/c10-15(12,13)14-9-3-1-2-6-7(9)4-5-8(6)11/h1-3,8H,4-5,11H2/t8-/m1/s1 |
| InChIKey | InChI | 1.06 | RYLHEHRDZCXSQL-MRVPVSSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H]1CCc2c(O[S](F)(=O)=O)cccc12 |
| SMILES | CACTVS | 3.385 | N[CH]1CCc2c(O[S](F)(=O)=O)cccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(c(c1)OS(=O)(=O)F)CC[C@H]2N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(c(c1)OS(=O)(=O)F)CCC2N |
