WQV
Summary
Name: | N-(5-bromo-2-oxo-1,2-dihydropyridin-3-yl)acetamide |
Formula: | C7 H7 Br N2 O2 |
Formal charge: | 0 |
Formula weight: | 231.047 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-(5-bromo-2-oxo-1,2-dihydropyridin-3-yl)acetamide |
OpenEye OEToolkits | 2.0.7 | ~{N}-(5-bromanyl-2-oxidanylidene-1~{H}-pyridin-3-yl)ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N1C(=O)C(NC(=O)C)=CC(=C1)Br |
InChI | InChI | 1.03 | InChI=1S/C7H7BrN2O2/c1-4(11)10-6-2-5(8)3-9-7(6)12/h2-3H,1H3,(H,9,12)(H,10,11) |
InChIKey | InChI | 1.03 | DZPXAAPHBCJNCQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)NC1=CC(=CNC1=O)Br |
SMILES | CACTVS | 3.385 | CC(=O)NC1=CC(=CNC1=O)Br |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)NC1=CC(=CNC1=O)Br |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)NC1=CC(=CNC1=O)Br |