chlorotrianisene

Properties Image MNX_ID MNXM46495 reference chebi:3641 formula C23H21ClO3 global charge 0 mol weight 380.871 InChIKey BFPSDSIWYFKGBC-UHFFFAOYSA-N InChI InChI=1S/C23H21ClO3/c1-25-19-10-4-16(5-11-19)22(17-6-12-20(26-2)13-7-17)23(24)18-8-14-21(27-3)15-9-18/h4-15H,1-3H3 SMILES COC1=CC=C(C(Cl)=C(C2=CC=C(OC)C=C2)C2=CC=C(OC)C=C2)C=C1 MNX internals InChI (mnx) InChI=1/C23H21ClO3/c1-25-19-10-4-16(5-11-19)22(17-6-12-20(26-2)13-7-17)23(24)18-8-14-21(27-3)15-9-18/h4-15H,1-3H3 SMILES (mnx) [CH3:1][O:25][C:19]1=[CH:11][CH:5]=[C:16]([C:22]([C:17]2=[CH:7][CH:13]=[C:20]([O:26][CH3:2])[CH:12]=[CH:6]2)=[C:23]([C:18]2=[CH:9][CH:15]=[C:21]([O:27][CH3:3])[CH:14]=[CH:8]2)[Cl:24])[CH:4]=[CH:10]1

Parent-child relations graph

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