7RE
Summary
Name: | 6-methyl-3H-pyridin-2-one |
Synonyms: | 2(3H)-Pyridinone, 6-methyl- 6-Methylpyridin-2(3H)-one |
Formula: | C6 H7 N O |
Formal charge: | 0 |
Formula weight: | 109.126 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 6-methyl-3~{H}-pyridin-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C6H7NO/c1-5-3-2-4-6(8)7-5/h2-3H,4H2,1H3 |
InChIKey | InChI | 1.03 | YQDSOMNGEOIBBG-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC1=NC(=O)CC=C1 |
SMILES | CACTVS | 3.385 | CC1=NC(=O)CC=C1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1=NC(=O)CC=C1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1=NC(=O)CC=C1 |