PRV
Summary
| Name: | (2R)-amino(2-nitrophenyl)ethanoic acid |
| Synonyms: | 2-(NITRO)PHENYLGLYCINE |
| Formula: | C8 H8 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 196.16 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R)-amino(2-nitrophenyl)ethanoic acid |
| OpenEye OEToolkits | 1.6.1 | (2R)-2-amino-2-(2-nitrophenyl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | [O-][N+](=O)c1ccccc1C(N)C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.352 | N[C@@H](C(O)=O)c1ccccc1[N+]([O-])=O |
| SMILES | CACTVS | 3.352 | N[CH](C(O)=O)c1ccccc1[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1ccc(c(c1)[C@H](C(=O)O)N)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.6.1 | c1ccc(c(c1)C(C(=O)O)N)[N+](=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C8H8N2O4/c9-7(8(11)12)5-3-1-2-4-6(5)10(13)14/h1-4,7H,9H2,(H,11,12)/t7-/m1/s1 |
| InChIKey | InChI | 1.03 | CEBXNGWSHWJBHX-SSDOTTSWSA-N |
