compound 0237270

Properties Image MNX_ID MNXM1186964 reference envipathM:...7631a92b3c80 formula C15H14ClN2O6 global charge -1 mol weight 353.738 InChIKey LDVOOSFWJBMERF-UHFFFAOYSA-M InChI InChI=1S/C15H15ClN2O6/c1-6(11(19)12(20)15(23)24)10-8-5-7(16)3-4-9(8)18(2)14(22)13(21)17-10/h3-6,11,13,19,21H,1-2H3,(H,23,24)/p-1 SMILES CC(C1=NC(O)C(=O)N(C)C2=C1C=C(Cl)C=C2)C(O)C(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C15H15ClN2O6/c1-6(11(19)12(20)15(23)24)10-8-5-7(16)3-4-9(8)18(2)14(22)13(21)17-10/h3-6,11,13,19,21H,1-2H3,(H,23,24)/t6?,11?,13? SMILES (mnx) [CH3:1][CH:6]([C:10]1=[N:17][CH:13]([OH:21])[C:14](=[O:22])[N:18]([CH3:2])[C:9]2=[C:8]1[CH:5]=[C:7]([Cl:16])[CH:3]=[CH:4]2)[CH:11]([C:12]([C:15]([OH:23])=[O:24])=[O:20])[OH:19]

Parent-child relations graph

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