Hydroxybupropion

Properties Image MNX_ID MNXM18601 reference chebi:166487 formula C13H18ClNO2 global charge 0 mol weight 255.745 InChIKey AKOAEVOSDHIVFX-UHFFFAOYSA-N InChI InChI=1S/C13H18ClNO2/c1-9(15-13(2,3)8-16)12(17)10-5-4-6-11(14)7-10/h4-7,9,15-16H,8H2,1-3H3 SMILES CC(NC(C)(C)CO)C(=O)C1=CC(Cl)=CC=C1 MNX internals InChI (mnx) InChI=1/C13H18ClNO2/c1-9(15-13(2,3)8-16)12(17)10-5-4-6-11(14)7-10/h4-7,9,15-16H,8H2,1-3H3/t9? SMILES (mnx) [CH3:1][CH:9]([C:12]([C:10]1=[CH:7][C:11]([Cl:14])=[CH:6][CH:4]=[CH:5]1)=[O:17])[NH:15][C:13]([CH3:2])([CH3:3])[CH2:8][OH:16]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0