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

Systemtic Name: ethyl-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: ethyl-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-(4-pyridylmethyl)ammonium CAS Name: ethyl-[[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: ethyl-[[3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: ethyl-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-(4-pyridylmethyl)ammonium Formula: C25H26FN4O+ MolecularWeight: 417.498543

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=NC=C1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

Isomeric SMILES

CC[NH+](CC1=CC=NC=C1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

InChI

InChI=1S/C25H25FN4O/c1-3-29(16-19-11-13-27-14-12-19)17-20-18-30(21-7-5-4-6-8-21)28-25(20)23-10-9-22(31-2)15-24(23)26/h4-15,18H,3,16-17H2,1-2H3/p+1