[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)azanium

Systemtic Name: [3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)azanium Openeye Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)ammonium CAS Name: [3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-methyl-(2-pyrazinylmethyl)ammonium IUPAC Name: [3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)azanium Traditional Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)ammonium Formula: C23H23FN5O+ MolecularWeight: 404.460023

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1C2=C(C=C(C=C2)OC)F)C3=CC=CC=C3)CC4=NC=CN=C4

Isomeric SMILES

C[NH+](CC1=CN(N=C1C2=C(C=C(C=C2)OC)F)C3=CC=CC=C3)CC4=NC=CN=C4

InChI

InChI=1S/C23H22FN5O/c1-28(16-18-13-25-10-11-26-18)14-17-15-29(19-6-4-3-5-7-19)27-23(17)21-9-8-20(30-2)12-22(21)24/h3-13,15H,14,16H2,1-2H3/p+1