compound 0229904

Properties Image MNX_ID MNXM1188350 reference envipathM:...a4685865416b formula C16H18N2O2 global charge 0 mol weight 270.332 InChIKey IAFGNIIKMIQSAP-UHFFFAOYSA-N InChI InChI=1S/C16H18N2O2/c19-8-13(20)11-4-3-9-1-2-10-5-6-17-16-15(10)14(9)12(11)7-18-16/h1-3,7,10-12,14-15,19H,4-6,8H2 SMILES O=C(CO)C1CC=C2C=CC3CCN=C4N=CC1C2C43 MNX internals InChI (mnx) InChI=1/C16H18N2O2/c19-8-13(20)11-4-3-9-1-2-10-5-6-17-16-15(10)14(9)12(11)7-18-16/h1-3,7,10-12,14-15,19H,4-6,8H2/t10?,11?,12?,14?,15? SMILES (mnx) [CH:1]1=[CH:2][CH:10]2[CH2:5][CH2:6][N:17]=[C:16]3[CH:15]2[CH:14]2[C:9]1=[CH:3][CH2:4][CH:11]([C:13]([CH2:8][OH:19])=[O:20])[CH:12]2[CH:7]=[N:18]3

Parent-child relations graph

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