L3V
Summary
Name: | N-[4-(hydroxymethyl)phenyl]acetamide |
Formula: | C9 H11 N O2 |
Formal charge: | 0 |
Formula weight: | 165.189 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-[4-(hydroxymethyl)phenyl]acetamide |
OpenEye OEToolkits | 2.0.7 | ~{N}-[4-(hydroxymethyl)phenyl]ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CC(=O)Nc1ccc(CO)cc1 |
InChI | InChI | 1.03 | InChI=1S/C9H11NO2/c1-7(12)10-9-4-2-8(6-11)3-5-9/h2-5,11H,6H2,1H3,(H,10,12) |
InChIKey | InChI | 1.03 | XEYORFKUJZEQCH-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(CO)cc1 |
SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(CO)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cc1)CO |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cc1)CO |