5AO
Summary
| Name: | 3-(1,3-oxazol-5-yl)aniline |
| Formula: | C9 H8 N2 O |
| Formal charge: | 0 |
| Formula weight: | 160.173 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-(1,3-oxazol-5-yl)aniline |
| OpenEye OEToolkits | 1.7.0 | 3-(1,3-oxazol-5-yl)aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1cc(oc1)c2cc(ccc2)N |
| SMILES_CANONICAL | CACTVS | 3.370 | Nc1cccc(c1)c2ocnc2 |
| SMILES | CACTVS | 3.370 | Nc1cccc(c1)c2ocnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(cc(c1)N)c2cnco2 |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(cc(c1)N)c2cnco2 |
| InChI | InChI | 1.03 | InChI=1S/C9H8N2O/c10-8-3-1-2-7(4-8)9-5-11-6-12-9/h1-6H,10H2 |
| InChIKey | InChI | 1.03 | AIELNJDAOGTASK-UHFFFAOYSA-N |
