UJQ
Summary
| Name: | 9~{H}-xanthene-9-carboxylic acid |
| Formula: | C14 H10 O3 |
| Formal charge: | 0 |
| Formula weight: | 226.227 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 9~{H}-xanthene-9-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H10O3/c15-14(16)13-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)13/h1-8,13H,(H,15,16) |
| InChIKey | InChI | 1.03 | VSBFNCXKYIEYIS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C1c2ccccc2Oc3ccccc13 |
| SMILES | CACTVS | 3.385 | OC(=O)C1c2ccccc2Oc3ccccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(c3ccccc3O2)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(c3ccccc3O2)C(=O)O |
