| Properties | Image | Occurences in reactions |
MNX_ID | MNXM160817 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C16H26BrClN2O4 |
charge | 0 |
mass | 424.07645 |
reference | keggD:D02683 |
InChIKey | SPFVHFBNXPARTR-IDMXKUIJSA-N |
InChI | InChI=1S/C16H23BrN2O3.ClH.H2O/c1-4-19-9-5-6-11(19)10-18-16(20)14-13(21-2)8-7-12(17)15(14)22-3;;/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,20);1H;1H2/t11-;;/m0../s1 |
SMILES | CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1OC.Cl.O |
|