diazaborine

Properties Image MNX_ID MNXM155289 reference chebi:83945 formula C14H13BN2O3S global charge 0 mol weight 300.148 InChIKey UQIDNSKBUXCODH-UHFFFAOYSA-N InChI InChI=1S/C14H13BN2O3S/c1-11-6-8-13(9-7-11)21(19,20)17-15(18)14-5-3-2-4-12(14)10-16-17/h2-10,18H,1H3 SMILES CC1=CC=C(S(=O)(=O)N2N=CC3=C(C=CC=C3)B2O)C=C1 MNX internals InChI (mnx) InChI=1/C14H13BN2O3S/c1-11-6-8-13(9-7-11)21(19,20)17-15(18)14-5-3-2-4-12(14)10-16-17/h2-10,18H,1H3 SMILES (mnx) [CH3:1][C:11]1=[CH:7][CH:9]=[C:13]([S:21]([N:17]2[B:15]([OH:18])[C:14]3=[CH:5][CH:3]=[CH:2][CH:4]=[C:12]3[CH:10]=[N:16]2)(=[O:19])=[O:20])[CH:8]=[CH:6]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0