compound 0236848

Properties Image MNX_ID MNXM1138945 reference envipathM:...bad276e82c1a formula C14H10ClN2O5 global charge -1 mol weight 321.696 InChIKey KCADYAZKNMCQNU-UHFFFAOYSA-M InChI InChI=1S/C14H11ClN2O5/c1-2-7(11(18)14(21)22)10-8-5-6(15)3-4-9(8)16-12(19)13(20)17-10/h2-5,7,13,20H,1H2,(H,16,19)(H,21,22)/p-1 SMILES C=CC(C(=O)C(=O)[O-])C1=NC(O)C(=O)NC2=C1C=C(Cl)C=C2 MNX internals InChI (mnx) InChI=1/C14H11ClN2O5/c1-2-7(11(18)14(21)22)10-8-5-6(15)3-4-9(8)16-12(19)13(20)17-10/h2-5,7,13,20H,1H2,(H,16,19)(H,21,22)/t7?,13? SMILES (mnx) [CH2:1]=[CH:2][CH:7]([C:10]1=[N:17][CH:13]([OH:20])[C:12]([OH:19])=[N:16][C:9]2=[C:8]1[CH:5]=[C:6]([Cl:15])[CH:3]=[CH:4]2)[C:11]([C:14]([OH:21])=[O:22])=[O:18]

Parent-child relations graph

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