KOK
Summary
| Name: | (2,3-dihydro-1H-indol-1-yl)(1H-1,2,3-triazol-1-yl)methanone |
| Formula: | C11 H10 N4 O |
| Formal charge: | 0 |
| Formula weight: | 214.223 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2,3-dihydro-1H-indol-1-yl)(1H-1,2,3-triazol-1-yl)methanone |
| OpenEye OEToolkits | 2.0.6 | 2,3-dihydroindol-1-yl(1,2,3-triazol-1-yl)methanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(n1ccnn1)N2c3c(CC2)cccc3 |
| InChI | InChI | 1.03 | InChI=1S/C11H10N4O/c16-11(15-8-6-12-13-15)14-7-5-9-3-1-2-4-10(9)14/h1-4,6,8H,5,7H2 |
| InChIKey | InChI | 1.03 | YHDLKWQIQYNPEK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(n1ccnn1)N2CCc3ccccc23 |
| SMILES | CACTVS | 3.385 | O=C(n1ccnn1)N2CCc3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)CCN2C(=O)n3ccnn3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)CCN2C(=O)n3ccnn3 |
