1,8-Dinitropyrene

Properties Image MNX_ID MNXM32412 reference chebi:34069 formula C16H8N2O4 global charge 0 mol weight 292.25 InChIKey BLYXNIHKOMELAP-UHFFFAOYSA-N InChI InChI=1S/C16H8N2O4/c19-17(20)13-7-3-9-1-2-10-4-8-14(18(21)22)12-6-5-11(13)15(9)16(10)12/h1-8H SMILES O=[N+]([O-])C1=CC=C2C=CC3=CC=C([N+](=O)[O-])C4=C3C2=C1C=C4 MNX internals InChI (mnx) InChI=1/C16H8N2O4/c19-17(20)13-7-3-9-1-2-10-4-8-14(18(21)22)12-6-5-11(13)15(9)16(10)12/h1-8H SMILES (mnx) [CH:1]1=[CH:2][C:10]2=[CH:4][CH:8]=[C:14]([N+:18]([O-:21])=[O:22])[C:12]3=[C:16]2[C:15]2=[C:11]([CH:5]=[CH:6]3)[C:13]([N+:17]([O-:19])=[O:20])=[CH:7][CH:3]=[C:9]12

Parent-child relations graph

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