PHK
Summary
| Name: | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-BUTAN-2-OL |
| Formula: | C10 H14 Cl N O |
| Formal charge: | 0 |
| Formula weight: | 199.677 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R,3S)-3-amino-1-chloro-4-phenylbutan-2-ol |
| OpenEye OEToolkits | 1.5.0 | (2R,3S)-3-amino-1-chloro-4-phenyl-butan-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | ClCC(O)C(N)Cc1ccccc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](Cc1ccccc1)[C@@H](O)CCl |
| SMILES | CACTVS | 3.341 | N[CH](Cc1ccccc1)[CH](O)CCl |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C[C@@H]([C@H](CCl)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CC(C(CCl)O)N |
| InChI | InChI | 1.03 | InChI=1S/C10H14ClNO/c11-7-10(13)9(12)6-8-4-2-1-3-5-8/h1-5,9-10,13H,6-7,12H2/t9-,10-/m0/s1 |
| InChIKey | InChI | 1.03 | YXWOYBQZWSLSMU-UWVGGRQHSA-N |
