OUZ
Summary
Name: | ~{N}-ethyl-2-[(2~{S},5~{R})-5-methyl-2-phenyl-morpholin-4-yl]ethanamine |
Formula: | C15 H24 N2 O |
Formal charge: | 0 |
Formula weight: | 248.364 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-ethyl-2-[(2~{S},5~{R})-5-methyl-2-phenyl-morpholin-4-yl]ethanamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C15H24N2O/c1-3-16-9-10-17-11-15(18-12-13(17)2)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12H2,1-2H3/t13-,15-/m1/s1 |
InChIKey | InChI | 1.03 | VKGGANBMWGYYDB-UKRRQHHQSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCNCCN1C[C@@H](OC[C@H]1C)c2ccccc2 |
SMILES | CACTVS | 3.385 | CCNCCN1C[CH](OC[CH]1C)c2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCNCCN1C[C@@H](OC[C@H]1C)c2ccccc2 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCNCCN1CC(OCC1C)c2ccccc2 |