NU1
Summary
| Name: | 8-HYDROXY-2-METHYL-3-HYDRO-QUINAZOLIN-4-ONE |
| Synonyms: | NU1025 |
| Formula: | C9 H8 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 176.172 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 8-hydroxy-2-methylquinazolin-4(3H)-one |
| OpenEye OEToolkits | 1.5.0 | 8-hydroxy-2-methyl-3H-quinazolin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1c2c(N=C(N1)C)c(O)ccc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | CC1=Nc2c(O)cccc2C(=O)N1 |
| SMILES | CACTVS | 3.341 | CC1=Nc2c(O)cccc2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1=Nc2c(cccc2O)C(=O)N1 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1=Nc2c(cccc2O)C(=O)N1 |
| InChI | InChI | 1.03 | InChI=1S/C9H8N2O2/c1-5-10-8-6(9(13)11-5)3-2-4-7(8)12/h2-4,12H,1H3,(H,10,11,13) |
| InChIKey | InChI | 1.03 | YJDAOHJWLUNFLX-UHFFFAOYSA-N |
