A1L8C
Summary
| Name: | 7,8-bis(oxidanyl)chromen-2-one |
| Synonyms: | daphnetin |
| Formula: | C9 H6 O4 |
| Formal charge: | 0 |
| Formula weight: | 178.142 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 7,8-bis(oxidanyl)chromen-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H |
| InChIKey | InChI | 1.06 | ATEFPOUAMCWAQS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc2C=CC(=O)Oc2c1O |
| SMILES | CACTVS | 3.385 | Oc1ccc2C=CC(=O)Oc2c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c2c1C=CC(=O)O2)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c2c1C=CC(=O)O2)O)O |
