NUH
Summary
Name: | 5-(3-methoxyphenyl)-1-methyl-pyridin-2-one |
Synonyms: | 5-(1-(1,3-dimethoxypropan-2-yl)-5-morpholino-1H-benzo[d]imidazol-2-yl)-1,3-dimethylpyridin-2(1H)-one |
Formula: | C13 H13 N O2 |
Formal charge: | 0 |
Formula weight: | 215.248 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 5-(3-methoxyphenyl)-1-methyl-pyridin-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C13H13NO2/c1-14-9-11(6-7-13(14)15)10-4-3-5-12(8-10)16-2/h3-9H,1-2H3 |
InChIKey | InChI | 1.03 | WBOQDJCUHPQCRG-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(c1)C2=CN(C)C(=O)C=C2 |
SMILES | CACTVS | 3.385 | COc1cccc(c1)C2=CN(C)C(=O)C=C2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1C=C(C=CC1=O)c2cccc(c2)OC |
SMILES | OpenEye OEToolkits | 2.0.7 | CN1C=C(C=CC1=O)c2cccc(c2)OC |