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

Systemtic Name: [3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(oxan-4-ylmethyl)azanium Openeye Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(tetrahydropyran-4-ylmethyl)ammonium CAS Name: [3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-methyl-(4-oxanylmethyl)ammonium IUPAC Name: [3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl-methyl-(oxan-4-ylmethyl)azanium Traditional Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(tetrahydropyran-4-ylmethyl)ammonium Formula: C24H29FN3O2+ MolecularWeight: 410.504363

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1CCOCC1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1CCOCC1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

InChI

InChI=1S/C24H28FN3O2/c1-27(15-18-10-12-30-13-11-18)16-19-17-28(20-6-4-3-5-7-20)26-24(19)22-9-8-21(29-2)14-23(22)25/h3-9,14,17-18H,10-13,15-16H2,1-2H3/p+1