A1CNC
Summary
| Name: | 4-(dimethylamino)-N-ethyl-3-fluorobenzamide |
| Formula: | C11 H15 F N2 O |
| Formal charge: | 0 |
| Formula weight: | 210.248 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 4-(dimethylamino)-N-ethyl-3-fluorobenzamide |
| OpenEye OEToolkits | 3.1.0.0 | 4-(dimethylamino)-~{N}-ethyl-3-fluoranyl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Fc1cc(ccc1N(C)C)C(=O)NCC |
| InChI | InChI | 1.06 | InChI=1S/C11H15FN2O/c1-4-13-11(15)8-5-6-10(14(2)3)9(12)7-8/h5-7H,4H2,1-3H3,(H,13,15) |
| InChIKey | InChI | 1.06 | DKFKPKCWATUBSJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCNC(=O)c1ccc(N(C)C)c(F)c1 |
| SMILES | CACTVS | 3.385 | CCNC(=O)c1ccc(N(C)C)c(F)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CCNC(=O)c1ccc(c(c1)F)N(C)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CCNC(=O)c1ccc(c(c1)F)N(C)C |
