LT2
Summary
| Name: | (3S)-3-hydroxy-2,3-dihydro-1H-indole-5,6-dione |
| Formula: | C8 H7 N O3 |
| Formal charge: | 0 |
| Formula weight: | 165.146 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (3S)-3-hydroxy-2,3-dihydro-1H-indole-5,6-dione |
| OpenEye OEToolkits | 1.5.0 | (3S)-3-hydroxy-2,3-dihydro-1H-indole-5,6-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C=C2C(=CC1=O)NCC2O |
| SMILES_CANONICAL | CACTVS | 3.341 | O[C@@H]1CNC2=CC(=O)C(=O)C=C12 |
| SMILES | CACTVS | 3.341 | O[CH]1CNC2=CC(=O)C(=O)C=C12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1[C@H](C2=CC(=O)C(=O)C=C2N1)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1C(C2=CC(=O)C(=O)C=C2N1)O |
| InChI | InChI | 1.03 | InChI=1S/C8H7NO3/c10-6-1-4-5(2-7(6)11)9-3-8(4)12/h1-2,8-9,12H,3H2/t8-/m1/s1 |
| InChIKey | InChI | 1.03 | LXXQZMIOKXLXPT-MRVPVSSYSA-N |
