E5H
Summary
Name: | 2-(4-phenylphenoxy)-~{N}-(3-piperidin-1-ylpropyl)ethanamide |
Formula: | C22 H28 N2 O2 |
Formal charge: | 0 |
Formula weight: | 352.47 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 2-(4-phenylphenoxy)-~{N}-(3-piperidin-1-ylpropyl)ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C22H28N2O2/c25-22(23-14-7-17-24-15-5-2-6-16-24)18-26-21-12-10-20(11-13-21)19-8-3-1-4-9-19/h1,3-4,8-13H,2,5-7,14-18H2,(H,23,25) |
InChIKey | InChI | 1.03 | IYYRFRHVGUOBGU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C(COc1ccc(cc1)c2ccccc2)NCCCN3CCCCC3 |
SMILES | CACTVS | 3.385 | O=C(COc1ccc(cc1)c2ccccc2)NCCCN3CCCCC3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)c2ccc(cc2)OCC(=O)NCCCN3CCCCC3 |
SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)c2ccc(cc2)OCC(=O)NCCCN3CCCCC3 |