7MZ
Summary
Name: | 1-(3-pyrimidin-2-yloxyphenyl)ethanone |
Formula: | C12 H10 N2 O2 |
Formal charge: | 0 |
Formula weight: | 214.22 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 1-(3-pyrimidin-2-yloxyphenyl)ethanone |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H10N2O2/c1-9(15)10-4-2-5-11(8-10)16-12-13-6-3-7-14-12/h2-8H,1H3 |
InChIKey | InChI | 1.03 | OMHNTGPQUCHKHG-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)c1cccc(Oc2ncccn2)c1 |
SMILES | CACTVS | 3.385 | CC(=O)c1cccc(Oc2ncccn2)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)c1cccc(c1)Oc2ncccn2 |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)c1cccc(c1)Oc2ncccn2 |