compound 0289424

Properties Image MNX_ID MNXM1188245 reference envipathM:...8545e3df7b29 formula C12H13N2O4 global charge -1 mol weight 249.246 InChIKey MEDFWJPKIRZKPQ-UHFFFAOYSA-M InChI InChI=1S/C12H14N2O4/c13-9(12(17)18)6-11(16)10(7-15)14-8-4-2-1-3-5-8/h1-6,10,14-15H,7,13H2,(H,17,18)/p-1 SMILES NC(=CC(=O)C(CO)NC1=CC=CC=C1)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C12H14N2O4/c13-9(12(17)18)6-11(16)10(7-15)14-8-4-2-1-3-5-8/h1-6,10,14-15H,7,13H2,(H,17,18)/b9-6?/t10? SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:8]([NH:14][CH:10]([CH2:7][OH:15])[C:11]([CH:6]=[C:9]([C:12](=[O:17])[OH:18])[NH2:13])=[O:16])[CH:5]=[CH:3]1

Parent-child relations graph

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