GT4
Summary
Name: | ~{N}-(4-hydroxyphenyl)-2-methoxy-ethanamide |
Formula: | C9 H11 N O3 |
Formal charge: | 0 |
Formula weight: | 181.189 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | ~{N}-(4-hydroxyphenyl)-2-methoxy-ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H11NO3/c1-13-6-9(12)10-7-2-4-8(11)5-3-7/h2-5,11H,6H2,1H3,(H,10,12) |
InChIKey | InChI | 1.03 | NSZUGQROUUTGGI-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COCC(=O)Nc1ccc(O)cc1 |
SMILES | CACTVS | 3.385 | COCC(=O)Nc1ccc(O)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COCC(=O)Nc1ccc(cc1)O |
SMILES | OpenEye OEToolkits | 2.0.6 | COCC(=O)Nc1ccc(cc1)O |