compound 0062077

Properties Image MNX_ID MNXM1172943 reference envipathM:...b6f16af571ba formula C12H21N3O2 global charge 0 mol weight 239.319 InChIKey YOWHIILLVCAODJ-UHFFFAOYSA-N InChI InChI=1S/C12H21N3O2/c1-6-9(13)7(2)11(15-17)8(10(6)14-16)12(3,4)5/h14-17H,13H2,1-5H3 SMILES CC1=C(N)C(C)=C(NO)C(C(C)(C)C)=C1NO MNX internals InChI (mnx) InChI=1/C12H21N3O2/c1-6-9(13)7(2)11(15-17)8(10(6)14-16)12(3,4)5/h14-17H,13H2,1-5H3 SMILES (mnx) [CH3:1][C:6]1=[C:9]([NH2:13])[C:7]([CH3:2])=[C:11]([NH:15][OH:17])[C:8]([C:12]([CH3:3])([CH3:4])[CH3:5])=[C:10]1[NH:14][OH:16]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0