M5E
Summary
| Name: | (~{S})-phenyl-[(2~{S})-pyrrolidin-2-yl]methanol |
| Formula: | C11 H15 N O |
| Formal charge: | 0 |
| Formula weight: | 177.243 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (~{S})-phenyl-[(2~{S})-pyrrolidin-2-yl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H15NO/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9/h1-3,5-6,10-13H,4,7-8H2/t10-,11-/m0/s1 |
| InChIKey | InChI | 1.03 | YPMHBZQROFTOSU-QWRGUYRKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@H]([C@@H]1CCCN1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | O[CH]([CH]1CCCN1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)[C@@H]([C@@H]2CCCN2)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C(C2CCCN2)O |
