HQB
Summary
| Name: | ~{N}-methyl-10-nitro-pyrido[3,4-g]quinazolin-2-amine |
| Formula: | C12 H9 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 255.232 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-methyl-10-nitro-pyrido[3,4-g]quinazolin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H9N5O2/c1-13-12-15-6-8-4-7-5-14-3-2-9(7)11(17(18)19)10(8)16-12/h2-6H,1H3,(H,13,15,16) |
| InChIKey | InChI | 1.03 | WJQCMHKMNXKJQR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNc1ncc2cc3cnccc3c(c2n1)[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | CNc1ncc2cc3cnccc3c(c2n1)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CNc1ncc2cc3cnccc3c(c2n1)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNc1ncc2cc3cnccc3c(c2n1)[N+](=O)[O-] |
