A1DOY
Summary
| Name: | 5-hydroxy-4-phenyl-1,2-oxazol-3(2H)-one |
| Formula: | C9 H7 N O3 |
| Formal charge: | 0 |
| Formula weight: | 177.157 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 5-hydroxy-4-phenyl-1,2-oxazol-3(2H)-one |
| OpenEye OEToolkits | 3.1.0.0 | 5-oxidanyl-4-phenyl-1,2-oxazol-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C1NOC(O)=C1c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C9H7NO3/c11-8-7(9(12)13-10-8)6-4-2-1-3-5-6/h1-5,12H,(H,10,11) |
| InChIKey | InChI | 1.06 | ZMSGYVXNYROULF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC1=C(C(=O)NO1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | OC1=C(C(=O)NO1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)C2=C(ONC2=O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)C2=C(ONC2=O)O |
