| Properties | Image |
|---|
| MNX_ID | MNXM107274 |
 |
| reference | chebi:70277 |
| formula | C19H28N2O3 |
| global charge | 0 |
| mol weight | 332.444 |
| InChIKey | NDZMZBQXLOVJER-AXTVGJDGSA-N |
| InChI | InChI=1S/C19H28N2O3/c1-14(2)7-5-8-15(3)9-6-10-19(4)17(24-19)11-16-12-18(20-13-16)21(22)23/h7,9,12-13,17,20H,5-6,8,10-11H2,1-4H3/b15-9+/t17-,19-/m1/s1 |
| SMILES | CC(C)=CCC/C(C)=C/CC[C@@]1(C)O[C@@H]1CC1=CNC([N+](=O)[O-])=C1 |
MNX internals
| InChI (mnx) | InChI=1/C19H28N2O3/c1-14(2)7-5-8-15(3)9-6-10-19(4)17(24-19)11-16-12-18(20-13-16)21(22)23/h7,9,12-13,17,20H,5-6,8,10-11H2,1-4H3/b15-9+/t17-,19-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:14]([CH3:2])=[CH:7][CH2:5][CH2:8]/[C:15]([CH3:3])=[CH:9]/[CH2:6][CH2:10][C@:19]1([CH3:4])[C@@H:17]([CH2:11][C:16]2=[CH:13][NH:20][C:18]([N+:21]([O-:22])=[O:23])=[CH:12]2)[O:24]1 |
|