YBU
Summary
| Name: | (5-phenyl-1,3,4-oxadiazol-2-yl)methanimine |
| Formula: | C9 H7 N3 O |
| Formal charge: | 0 |
| Formula weight: | 173.171 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (5-phenyl-1,3,4-oxadiazol-2-yl)methanimine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H7N3O/c10-6-8-11-12-9(13-8)7-4-2-1-3-5-7/h1-6,10H/b10-6- |
| InChIKey | InChI | 1.06 | YVGIABMOZOZHSD-POHAHGRESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N=Cc1oc(nn1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | N=Cc1oc(nn1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [H]/N=C\c1nnc(o1)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2nnc(o2)C=N |
