9FT
Summary
| Name: | (3R)-3-(4-methoxyphenyl)piperidine-2,6-dione |
| Formula: | C12 H13 N O3 |
| Formal charge: | 0 |
| Formula weight: | 219.237 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3R)-3-(4-methoxyphenyl)piperidine-2,6-dione |
| OpenEye OEToolkits | 2.0.7 | (3~{R})-3-(4-methoxyphenyl)piperidine-2,6-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1NC(=O)CCC1c1ccc(OC)cc1 |
| InChI | InChI | 1.03 | InChI=1S/C12H13NO3/c1-16-9-4-2-8(3-5-9)10-6-7-11(14)13-12(10)15/h2-5,10H,6-7H2,1H3,(H,13,14,15)/t10-/m1/s1 |
| InChIKey | InChI | 1.03 | UTEUBBDWRDGRCU-SNVBAGLBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)[C@H]2CCC(=O)NC2=O |
| SMILES | CACTVS | 3.385 | COc1ccc(cc1)[CH]2CCC(=O)NC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)[C@H]2CCC(=O)NC2=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)C2CCC(=O)NC2=O |
