UI8
Summary
| Name: | 7-$l^{3}-oxidanyl-12~{H}-[2,1]benzazaborolo[2,1-a][1,3,2]benzodiazaborinine |
| Formula: | C14 H12 B N2 O |
| Formal charge: | 0 |
| Formula weight: | 235.069 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 7-oxidanyl-12~{H}-[2,1]benzazaborolo[2,1-a][1,3,2]benzodiazaborinine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H12BN2O/c18-15-13-7-3-1-6-12(13)10-17(15)14-8-4-2-5-11(14)9-16-15/h1-9,18H,10H2 |
| InChIKey | InChI | 1.06 | UCHLFALBLFGNQN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[B]12N=Cc3ccccc3N1Cc4ccccc24 |
| SMILES | CACTVS | 3.385 | O[B]12N=Cc3ccccc3N1Cc4ccccc24 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | B12(c3ccccc3CN1c4ccccc4C=N2)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | B12(c3ccccc3CN1c4ccccc4C=N2)O |
