compound 0071874

Properties Image MNX_ID MNXM1184494 reference envipathM:...cdd2216e2db4 formula C16H20NO4 global charge -1 mol weight 290.339 InChIKey RMZFQEDUPJKSCR-UHFFFAOYSA-M InChI InChI=1S/C16H21NO4/c1-4-12(15(18)16(19)20)11-13-7-5-6-8-14(13)21-10-9-17(2)3/h4-8,12H,1,9-11H2,2-3H3,(H,19,20)/p-1 SMILES C=CC(CC1=C(OCCN(C)C)C=CC=C1)C(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C16H21NO4/c1-4-12(15(18)16(19)20)11-13-7-5-6-8-14(13)21-10-9-17(2)3/h4-8,12H,1,9-11H2,2-3H3,(H,19,20)/t12? SMILES (mnx) [CH2:1]=[CH:4][CH:12]([CH2:11][C:13]1=[CH:7][CH:5]=[CH:6][CH:8]=[C:14]1[O:21][CH2:10][CH2:9][N:17]([CH3:2])[CH3:3])[C:15]([C:16]([OH:19])=[O:20])=[O:18]

Parent-child relations graph

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