compound 0080809

Properties Image MNX_ID MNXM1173838 reference envipathM:...9306676c3f3d formula C19H18ClNO5 global charge 0 mol weight 375.808 InChIKey AQIADSADLIXUMF-CIAFOILYSA-N InChI InChI=1S/C19H18ClNO5/c1-12(18(24)19(25)13-6-8-15(20)9-7-13)21-26-11-14-4-2-3-5-16(14)17(23)10-22/h2-9,17,22-23H,10-11H2,1H3/b21-12+ SMILES C/C(=N\OCC1=C(C(O)CO)C=CC=C1)C(=O)C(=O)C1=CC=C(Cl)C=C1 MNX internals InChI (mnx) InChI=1/C19H18ClNO5/c1-12(18(24)19(25)13-6-8-15(20)9-7-13)21-26-11-14-4-2-3-5-16(14)17(23)10-22/h2-9,17,22-23H,10-11H2,1H3/b21-12+/t17? SMILES (mnx) [CH3:1]/[C:12]([C:18]([C:19]([C:13]1=[CH:7][CH:9]=[C:15]([Cl:20])[CH:8]=[CH:6]1)=[O:25])=[O:24])=[N:21]\[O:26][CH2:11][C:14]1=[CH:4][CH:2]=[CH:3][CH:5]=[C:16]1[CH:17]([CH2:10][OH:22])[OH:23]

Parent-child relations graph

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