TEV
Summary
| Name: | 6-methyl-2-oxo-2,5-dihydropyrimidine-4-carboxylic acid |
| Formula: | C6 H6 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 154.123 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-methyl-2-oxo-2,5-dihydropyrimidine-4-carboxylic acid |
| OpenEye OEToolkits | 2.0.7 | 6-methyl-2-oxidanylidene-5~{H}-pyrimidine-4-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1N=C(CC(=N1)C)C(O)=O |
| InChI | InChI | 1.03 | InChI=1S/C6H6N2O3/c1-3-2-4(5(9)10)8-6(11)7-3/h2H2,1H3,(H,9,10) |
| InChIKey | InChI | 1.03 | ZTBNONONIFESFB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1=NC(=O)N=C(C1)C(O)=O |
| SMILES | CACTVS | 3.385 | CC1=NC(=O)N=C(C1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1=NC(=O)N=C(C1)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1=NC(=O)N=C(C1)C(=O)O |
