A1KEW
Summary
| Name: | ~{N}-(1-ethyl-2-oxidanylidene-3,4-dihydroquinolin-6-yl)ethanamide |
| Formula: | C13 H16 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 232.278 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(1-ethyl-2-oxidanylidene-3,4-dihydroquinolin-6-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H16N2O2/c1-3-15-12-6-5-11(14-9(2)16)8-10(12)4-7-13(15)17/h5-6,8H,3-4,7H2,1-2H3,(H,14,16) |
| InChIKey | InChI | 1.06 | MZSXFDKKEASJTN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN1C(=O)CCc2cc(NC(C)=O)ccc12 |
| SMILES | CACTVS | 3.385 | CCN1C(=O)CCc2cc(NC(C)=O)ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCN1c2ccc(cc2CCC1=O)NC(=O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCN1c2ccc(cc2CCC1=O)NC(=O)C |
