IAG
Summary
| Name: | N-[1H-INDOL-3-YL-ACETYL]GLYCINE ACID |
| Formula: | C12 H12 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 232.235 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-(1H-indol-3-ylacetyl)glycine |
| OpenEye OEToolkits | 1.5.0 | 2-[2-(1H-indol-3-yl)ethanoylamino]ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CNC(=O)Cc2c1ccccc1nc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)CNC(=O)Cc1c[nH]c2ccccc12 |
| SMILES | CACTVS | 3.341 | OC(=O)CNC(=O)Cc1c[nH]c2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c[nH]2)CC(=O)NCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c[nH]2)CC(=O)NCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C12H12N2O3/c15-11(14-7-12(16)17)5-8-6-13-10-4-2-1-3-9(8)10/h1-4,6,13H,5,7H2,(H,14,15)(H,16,17) |
| InChIKey | InChI | 1.03 | YDXXLJMIHMIOIF-UHFFFAOYSA-N |
