compound 0068109

Properties Image MNX_ID MNXM1179762 reference envipathM:...d1f8d044e219 formula C15H17Cl2N3O4 global charge 0 mol weight 374.224 InChIKey FKUMCFMRDHEQIM-UHFFFAOYSA-N InChI InChI=1S/C15H17Cl2N3O4/c16-11-3-4-13(14(17)6-11)15(23,8-20-10-18-9-19-20)24-12(7-22)2-1-5-21/h3-4,6-7,9-10,12,21,23H,1-2,5,8H2 SMILES O=CC(CCCO)OC(O)(CN1C=NC=N1)C1=CC=C(Cl)C=C1Cl MNX internals InChI (mnx) InChI=1/C15H17Cl2N3O4/c16-11-3-4-13(14(17)6-11)15(23,8-20-10-18-9-19-20)24-12(7-22)2-1-5-21/h3-4,6-7,9-10,12,21,23H,1-2,5,8H2/t12?,15? SMILES (mnx) [CH2:1]([CH2:2][CH:12]([CH:7]=[O:22])[O:24][C:15]([CH2:8][N:20]1[CH:10]=[N:18][CH:9]=[N:19]1)([C:13]1=[C:14]([Cl:17])[CH:6]=[C:11]([Cl:16])[CH:3]=[CH:4]1)[OH:23])[CH2:5][OH:21]

Parent-child relations graph

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