(4-dimethylaminophenyl)methyl-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium Formula: C25H26FN4+ MolecularWeight: 401.499143

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C[NH2+]CC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C[NH2+]CC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C25H25FN4/c1-29(2)23-14-8-19(9-15-23)16-27-17-21-18-30(24-6-4-3-5-7-24)28-25(21)20-10-12-22(26)13-11-20/h3-15,18,27H,16-17H2,1-2H3/p+1