MPQ
Summary
| Name: | N-METHYL-ALPHA-PHENYL-GLYCINE |
| Synonyms: | METHYLAMINO-PHENYL-ACETIC ACID |
| Formula: | C9 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 165.189 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2S)-(methylamino)(phenyl)ethanoic acid |
| OpenEye OEToolkits | 1.7.0 | (2S)-2-(methylamino)-2-phenyl-ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(NC)c1ccccc1 |
| SMILES_CANONICAL | CACTVS | 3.370 | CN[C@H](C(O)=O)c1ccccc1 |
| SMILES | CACTVS | 3.370 | CN[CH](C(O)=O)c1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CN[C@@H](c1ccccc1)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | CNC(c1ccccc1)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C9H11NO2/c1-10-8(9(11)12)7-5-3-2-4-6-7/h2-6,8,10H,1H3,(H,11,12)/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | HGIPIEYZJPULIQ-QMMMGPOBSA-N |
