6WG
Summary
| Name: | (2~{R})-2-phenylpiperidine-1-carbaldehyde |
| Formula: | C12 H15 N O |
| Formal charge: | 0 |
| Formula weight: | 189.254 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | (2~{R})-2-phenylpiperidine-1-carbaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H15NO/c14-10-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-3,6-7,10,12H,4-5,8-9H2/t12-/m1/s1 |
| InChIKey | InChI | 1.03 | MUZIXORETQNNBG-GFCCVEGCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=CN1CCCC[C@@H]1c2ccccc2 |
| SMILES | CACTVS | 3.385 | O=CN1CCCC[CH]1c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)[C@H]2CCCCN2C=O |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)C2CCCCN2C=O |
