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

Systemtic Name: [3-(3-fluoranyl-4-methoxy-phenyl)-1-(2-methylphenyl)pyrazol-4-yl]methyl-methyl-(oxan-4-ylmethyl)azanium Openeye Name: [3-(3-fluoro-4-methoxy-phenyl)-1-(o-tolyl)pyrazol-4-yl]methyl-methyl-(tetrahydropyran-4-ylmethyl)ammonium CAS Name: [3-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)-4-pyrazolyl]methyl-methyl-(4-oxanylmethyl)ammonium IUPAC Name: [3-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)pyrazol-4-yl]methyl-methyl-(oxan-4-ylmethyl)azanium Traditional Name: [3-(3-fluoro-4-methoxy-phenyl)-1-(o-tolyl)pyrazol-4-yl]methyl-methyl-(tetrahydropyran-4-ylmethyl)ammonium Formula: C25H31FN3O2+ MolecularWeight: 424.530943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=C(C(=N2)C3=CC(=C(C=C3)OC)F)C[NH+](C)CC4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C(=N2)C3=CC(=C(C=C3)OC)F)C[NH+](C)CC4CCOCC4

InChI

InChI=1S/C25H30FN3O2/c1-18-6-4-5-7-23(18)29-17-21(16-28(2)15-19-10-12-31-13-11-19)25(27-29)20-8-9-24(30-3)22(26)14-20/h4-9,14,17,19H,10-13,15-16H2,1-3H3/p+1