NF0
Summary
| Name: | butyl 3,4,5-tris(oxidanyl)benzoate |
| Synonyms: | butyl gallate |
| Formula: | C11 H14 O5 |
| Formal charge: | 0 |
| Formula weight: | 226.226 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | butyl 3,4,5-tris(oxidanyl)benzoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H14O5/c1-2-3-4-16-11(15)7-5-8(12)10(14)9(13)6-7/h5-6,12-14H,2-4H2,1H3 |
| InChIKey | InChI | 1.06 | XOPOEBVTQYAOSV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCOC(=O)c1cc(O)c(O)c(O)c1 |
| SMILES | CACTVS | 3.385 | CCCCOC(=O)c1cc(O)c(O)c(O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCOC(=O)c1cc(c(c(c1)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCOC(=O)c1cc(c(c(c1)O)O)O |
