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

Systemtic Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-N-methyl-2-nitro-aniline Openeye Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-N-methyl-2-nitro-aniline CAS Name: 4-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]methyl]-N-methyl-2-nitroaniline IUPAC Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-N-methyl-2-nitroaniline Traditional Name: [4-[[4-[bis(4-fluorophenyl)methyl]piperazino]methyl]-2-nitro-phenyl]-methyl-amine Formula: C25H26F2N4O2 MolecularWeight: 452.496346

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)CN2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)CN2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C25H26F2N4O2/c1-28-23-11-2-18(16-24(23)31(32)33)17-29-12-14-30(15-13-29)25(19-3-7-21(26)8-4-19)20-5-9-22(27)10-6-20/h2-11,16,25,28H,12-15,17H2,1H3