U7C
Summary
| Name: | 5-(1~{H}-indol-3-yl)-1,2-oxazole-3-carboxylic acid |
| Formula: | C12 H8 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 228.204 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-(1~{H}-indol-3-yl)-1,2-oxazole-3-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H8N2O3/c15-12(16)10-5-11(17-14-10)8-6-13-9-4-2-1-3-7(8)9/h1-6,13H,(H,15,16) |
| InChIKey | InChI | 1.06 | LTJHKDMGKKYAIF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cc(on1)c2c[nH]c3ccccc23 |
| SMILES | CACTVS | 3.385 | OC(=O)c1cc(on1)c2c[nH]c3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)c3cc(no3)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)c3cc(no3)C(=O)O |
