NV1
Summary
| Name: | 2-azanyl-~{N}-(2,6-dimethylphenyl)-~{N}-propan-2-yl-ethanamide |
| Formula: | C13 H20 N2 O |
| Formal charge: | 0 |
| Formula weight: | 220.311 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-azanyl-~{N}-(2,6-dimethylphenyl)-~{N}-propan-2-yl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H20N2O/c1-9(2)15(12(16)8-14)13-10(3)6-5-7-11(13)4/h5-7,9H,8,14H2,1-4H3 |
| InChIKey | InChI | 1.03 | XTROKJGKHGPNON-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)N(C(=O)CN)c1c(C)cccc1C |
| SMILES | CACTVS | 3.385 | CC(C)N(C(=O)CN)c1c(C)cccc1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1N(C(C)C)C(=O)CN)C |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cccc(c1N(C(C)C)C(=O)CN)C |
