0TI
Summary
| Name: | (3R)-5-fluoro-3-hydroxy-1,3-dihydro-2H-indol-2-one |
| Formula: | C8 H6 F N O2 |
| Formal charge: | 0 |
| Formula weight: | 167.137 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3R)-5-fluoro-3-hydroxy-1,3-dihydro-2H-indol-2-one |
| OpenEye OEToolkits | 1.7.6 | (3R)-5-fluoranyl-3-oxidanyl-1,3-dihydroindol-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2cc1NC(=O)C(O)c1cc2F |
| InChI | InChI | 1.03 | InChI=1S/C8H6FNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3,7,11H,(H,10,12)/t7-/m1/s1 |
| InChIKey | InChI | 1.03 | XYDTZHMQTYEJQN-SSDOTTSWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@H]1C(=O)Nc2ccc(F)cc12 |
| SMILES | CACTVS | 3.385 | O[CH]1C(=O)Nc2ccc(F)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1F)[C@H](C(=O)N2)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1F)C(C(=O)N2)O |
