4-[[4-[[2-(4-fluorophenyl)phenyl]methyl]piperazin-1-yl]methyl]-N-methyl-2-nitro-aniline

Systemtic Name: 4-[[4-[[2-(4-fluorophenyl)phenyl]methyl]piperazin-1-yl]methyl]-N-methyl-2-nitro-aniline Openeye Name: 4-[[4-[[2-(4-fluorophenyl)phenyl]methyl]piperazin-1-yl]methyl]-N-methyl-2-nitro-aniline CAS Name: 4-[[4-[[2-(4-fluorophenyl)phenyl]methyl]-1-piperazinyl]methyl]-N-methyl-2-nitroaniline IUPAC Name: 4-[[4-[[2-(4-fluorophenyl)phenyl]methyl]piperazin-1-yl]methyl]-N-methyl-2-nitroaniline Traditional Name: [4-[[4-[2-(4-fluorophenyl)benzyl]piperazino]methyl]-2-nitro-phenyl]-methyl-amine Formula: C25H27FN4O2 MolecularWeight: 434.505883

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)CN2CCN(CC2)CC3=CC=CC=C3C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)CN2CCN(CC2)CC3=CC=CC=C3C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C25H27FN4O2/c1-27-24-11-6-19(16-25(24)30(31)32)17-28-12-14-29(15-13-28)18-21-4-2-3-5-23(21)20-7-9-22(26)10-8-20/h2-11,16,27H,12-15,17-18H2,1H3