N-ethylharmine

Properties Image MNX_ID MNXM107034 reference chebi:66003 formula C15H16N2O global charge 0 mol weight 240.306 InChIKey IPKUPGYEVPMEEL-UHFFFAOYSA-N InChI InChI=1S/C15H16N2O/c1-4-17-14-9-11(18-3)5-6-12(14)13-7-8-16-10(2)15(13)17/h5-9H,4H2,1-3H3 SMILES CCN1C2=C(C=CC(OC)=C2)C2=C1C(C)=NC=C2 MNX internals InChI (mnx) InChI=1/C15H16N2O/c1-4-17-14-9-11(18-3)5-6-12(14)13-7-8-16-10(2)15(13)17/h5-9H,4H2,1-3H3 SMILES (mnx) [CH3:1][CH2:4][N:17]1[C:14]2=[C:12]([CH:6]=[CH:5][C:11]([O:18][CH3:3])=[CH:9]2)[C:13]2=[CH:7][CH:8]=[N:16][C:10]([CH3:2])=[C:15]21

Parent-child relations graph

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