MTJ
Summary
| Name: | N,O-DIMETHYL-L-TYROSINE |
| Formula: | C11 H15 N O3 |
| Formal charge: | 0 |
| Formula weight: | 209.242 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N,O-dimethyl-L-tyrosine |
| OpenEye OEToolkits | 1.5.0 | (2S)-3-(4-methoxyphenyl)-2-methylamino-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(NC)Cc1ccc(OC)cc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | CN[C@@H](Cc1ccc(OC)cc1)C(O)=O |
| SMILES | CACTVS | 3.341 | CN[CH](Cc1ccc(OC)cc1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN[C@@H](Cc1ccc(cc1)OC)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CNC(Cc1ccc(cc1)OC)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C11H15NO3/c1-12-10(11(13)14)7-8-3-5-9(15-2)6-4-8/h3-6,10,12H,7H2,1-2H3,(H,13,14)/t10-/m0/s1 |
| InChIKey | InChI | 1.03 | QESMMBKGCOSBNL-JTQLQIEISA-N |
