SGI
Summary
Name: | 3-(4-hydroxyphenyl)propanamide |
Formula: | C9 H11 N O2 |
Formal charge: | 0 |
Formula weight: | 165.189 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 3-(4-hydroxyphenyl)propanamide |
OpenEye OEToolkits | 1.5.0 | 3-(4-hydroxyphenyl)propanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(N)CCc1ccc(O)cc1 |
SMILES_CANONICAL | CACTVS | 3.341 | NC(=O)CCc1ccc(O)cc1 |
SMILES | CACTVS | 3.341 | NC(=O)CCc1ccc(O)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CCC(=O)N)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CCC(=O)N)O |
InChI | InChI | 1.03 | InChI=1S/C9H11NO2/c10-9(12)6-3-7-1-4-8(11)5-2-7/h1-2,4-5,11H,3,6H2,(H2,10,12) |
InChIKey | InChI | 1.03 | OEHZEBOCZWCVMK-UHFFFAOYSA-N |