1-[bis(4-fluorophenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

Properties Image MNX_ID MNXM342101 reference chebi:94682 formula C27H30F2N2O3 global charge 0 mol weight 468.544 InChIKey JQSAYKKFZOSZGJ-UHFFFAOYSA-N InChI InChI=1S/C27H30F2N2O3/c1-32-24-13-8-21(26(33-2)27(24)34-3)18-30-14-16-31(17-15-30)25(19-4-9-22(28)10-5-19)20-6-11-23(29)12-7-20/h4-13,25H,14-18H2,1-3H3 SMILES COC1=C(OC)C(OC)=C(CN2CCN(C(C3=CC=C(F)C=C3)C3=CC=C(F)C=C3)CC2)C=C1 MNX internals InChI (mnx) InChI=1/C27H30F2N2O3/c1-32-24-13-8-21(26(33-2)27(24)34-3)18-30-14-16-31(17-15-30)25(19-4-9-22(28)10-5-19)20-6-11-23(29)12-7-20/h4-13,25H,14-18H2,1-3H3 SMILES (mnx) [CH3:1][O:32][C:24]1=[C:27]([O:34][CH3:3])[C:26]([O:33][CH3:2])=[C:21]([CH2:18][N:30]2[CH2:14][CH2:16][N:31]([CH:25]([C:19]3=[CH:5][CH:10]=[C:22]([F:28])[CH:9]=[CH:4]3)[C:20]3=[CH:7][CH:12]=[C:23]([F:29])[CH:11]=[CH:6]3)[CH2:17][CH2:15]2)[CH:8]=[CH:13]1

Parent-child relations graph

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