1QB
Summary
| Name: | N-(4,7-dihydro-1H-inden-6-yl)acetamide |
| Formula: | C11 H13 N O |
| Formal charge: | 0 |
| Formula weight: | 175.227 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(4,7-dihydro-1H-inden-6-yl)acetamide |
| OpenEye OEToolkits | 1.7.6 | N-(4,7-dihydro-3H-inden-5-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NC2=CCC=1C=CCC=1C2)C |
| InChI | InChI | 1.03 | InChI=1S/C11H13NO/c1-8(13)12-11-6-5-9-3-2-4-10(9)7-11/h2-3,6H,4-5,7H2,1H3,(H,12,13) |
| InChIKey | InChI | 1.03 | KSMIDXVYBNGOED-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(=O)NC1=CCC2=C(CC=C2)C1 |
| SMILES | CACTVS | 3.370 | CC(=O)NC1=CCC2=C(CC=C2)C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=O)NC1=CCC2=C(C1)CC=C2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=O)NC1=CCC2=C(C1)CC=C2 |
