IB0
Summary
| Name: | (7-methyl-2,3-dihydroindol-1-yl)-(1,2,3-triazol-1-yl)methanone |
| Formula: | C12 H12 N4 O |
| Formal charge: | 0 |
| Formula weight: | 228.25 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (7-methyl-2,3-dihydroindol-1-yl)-(1,2,3-triazol-1-yl)methanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H12N4O/c1-9-3-2-4-10-5-7-15(11(9)10)12(17)16-8-6-13-14-16/h2-4,6,8H,5,7H2,1H3 |
| InChIKey | InChI | 1.06 | SKGYNFOODZJUGQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc2CCN(C(=O)n3ccnn3)c12 |
| SMILES | CACTVS | 3.385 | Cc1cccc2CCN(C(=O)n3ccnn3)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cccc2c1N(CC2)C(=O)n3ccnn3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cccc2c1N(CC2)C(=O)n3ccnn3 |
