28A
Summary
| Name: | 3-hydroxy-6-(3-methoxyphenyl)pyridin-2(5H)-one |
| Formula: | C12 H11 N O3 |
| Formal charge: | 0 |
| Formula weight: | 217.221 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-hydroxy-6-(3-methoxyphenyl)pyridin-2(5H)-one |
| OpenEye OEToolkits | 1.7.6 | 2-(3-methoxyphenyl)-5-oxidanyl-3H-pyridin-6-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2N=C(c1cccc(OC)c1)CC=C2O |
| InChI | InChI | 1.03 | InChI=1S/C12H11NO3/c1-16-9-4-2-3-8(7-9)10-5-6-11(14)12(15)13-10/h2-4,6-7,14H,5H2,1H3 |
| InChIKey | InChI | 1.03 | UGMJNFNGAUVDRE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(c1)C2=NC(=O)C(=CC2)O |
| SMILES | CACTVS | 3.385 | COc1cccc(c1)C2=NC(=O)C(=CC2)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | COc1cccc(c1)C2=NC(=O)C(=CC2)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | COc1cccc(c1)C2=NC(=O)C(=CC2)O |
