04G
Summary
| Name: | 7-hydroxy-3H-phenoxazin-3-one |
| Synonyms: | RESORUFIN |
| Formula: | C12 H7 N O3 |
| Formal charge: | 0 |
| Formula weight: | 213.189 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7-hydroxy-3H-phenoxazin-3-one |
| OpenEye OEToolkits | 1.7.2 | 7-oxidanylphenoxazin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2C=CC1=Nc3c(OC1=C2)cc(O)cc3 |
| InChI | InChI | 1.03 | InChI=1S/C12H7NO3/c14-7-1-3-9-11(5-7)16-12-6-8(15)2-4-10(12)13-9/h1-6,14H |
| InChIKey | InChI | 1.03 | HSSLDCABUXLXKM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Oc1ccc2N=C3C=CC(=O)C=C3Oc2c1 |
| SMILES | CACTVS | 3.370 | Oc1ccc2N=C3C=CC(=O)C=C3Oc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1cc2c(cc1O)OC3=CC(=O)C=CC3=N2 |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1cc2c(cc1O)OC3=CC(=O)C=CC3=N2 |
