compound 0060324

Properties Image MNX_ID MNXM1184549 reference envipathM:...e79502e63f6c formula C14H17ClNO4 global charge -1 mol weight 298.746 InChIKey PMUWEUZESLDWTE-UHFFFAOYSA-M InChI InChI=1S/C14H18ClNO4/c1-9-4-3-5-11(6-7-17)13(9)16(12(18)8-15)10(2)14(19)20/h3-5,10,17H,6-8H2,1-2H3,(H,19,20)/p-1 SMILES CC1=CC=CC(CCO)=C1N(C(=O)CCl)C(C)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C14H18ClNO4/c1-9-4-3-5-11(6-7-17)13(9)16(12(18)8-15)10(2)14(19)20/h3-5,10,17H,6-8H2,1-2H3,(H,19,20)/t10? SMILES (mnx) [CH3:1][C:9]1=[C:13]([N:16]([CH:10]([CH3:2])[C:14](=[O:19])[OH:20])[C:12]([CH2:8][Cl:15])=[O:18])[C:11]([CH2:6][CH2:7][OH:17])=[CH:5][CH:3]=[CH:4]1

Parent-child relations graph

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