1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-fluorophenyl)piperazin-1-ium

Systemtic Name: 1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-fluorophenyl)piperazin-1-ium Openeye Name: 1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-fluorophenyl)piperazin-1-ium CAS Name: 1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-fluorophenyl)piperazin-1-ium IUPAC Name: 1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-fluorophenyl)piperazin-1-ium Traditional Name: 1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-4-(2-fluorophenyl)piperazin-1-ium Formula: C20H21ClFN4+ MolecularWeight: 371.858943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(NN=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(NN=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4F

InChI

InChI=1S/C20H20ClFN4/c21-17-7-5-15(6-8-17)20-16(13-23-24-20)14-25-9-11-26(12-10-25)19-4-2-1-3-18(19)22/h1-8,13H,9-12,14H2,(H,23,24)/p+1