EZY
Summary
| Name: | N-[(2-nitrophenyl)methyl]glycine |
| Synonyms: | 2-nitrobenzylglycine |
| Formula: | C9 H10 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 210.187 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-[(2-nitrophenyl)methyl]glycine |
| OpenEye OEToolkits | 2.0.6 | 2-[(2-nitrophenyl)methylamino]ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(CC(=O)O)Cc1c(N(=O)=O)cccc1 |
| InChI | InChI | 1.03 | InChI=1S/C9H10N2O4/c12-9(13)6-10-5-7-3-1-2-4-8(7)11(14)15/h1-4,10H,5-6H2,(H,12,13) |
| InChIKey | InChI | 1.03 | PRJCIUDMDQNJCJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CNCc1ccccc1[N](=O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)CNCc1ccccc1[N](=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(c(c1)CNCC(=O)O)N(=O)=O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(c(c1)CNCC(=O)O)N(=O)=O |
