SQ2
Summary
| Name: | 2-(1H-1,2,3-benzotriazol-1-yl)-1-(4-methylpiperidin-1-yl)ethan-1-one |
| Synonyms: | 2-(benzotriazol-1-yl)-1-(4-methylpiperidin-1-yl)ethanone |
| Formula: | C14 H18 N4 O |
| Formal charge: | 0 |
| Formula weight: | 258.319 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-(benzotriazol-1-yl)-1-(4-methylpiperidin-1-yl)ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H18N4O/c1-11-6-8-17(9-7-11)14(19)10-18-13-5-3-2-4-12(13)15-16-18/h2-5,11H,6-10H2,1H3 |
| InChIKey | InChI | 1.03 | CTUYCKVPYLPOTM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1CCN(CC1)C(=O)Cn2nnc3ccccc23 |
| SMILES | CACTVS | 3.385 | CC1CCN(CC1)C(=O)Cn2nnc3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1CCN(CC1)C(=O)Cn2c3ccccc3nn2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1CCN(CC1)C(=O)Cn2c3ccccc3nn2 |
