[3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-methyl-(oxan-4-yl)azanium

Systemtic Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-methyl-(oxan-4-yl)azanium Openeye Name: [3-(3-fluorophenyl)-1-(m-tolyl)pyrazol-4-yl]methyl-methyl-tetrahydropyran-4-yl-ammonium CAS Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)-4-pyrazolyl]methyl-methyl-(4-oxanyl)ammonium IUPAC Name: [3-(3-fluorophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methyl-methyl-(oxan-4-yl)azanium Traditional Name: [3-(3-fluorophenyl)-1-(m-tolyl)pyrazol-4-yl]methyl-methyl-tetrahydropyran-4-yl-ammonium Formula: C23H27FN3O+ MolecularWeight: 380.478383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=C(C(=N2)C3=CC(=CC=C3)F)C[NH+](C)C4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2C=C(C(=N2)C3=CC(=CC=C3)F)C[NH+](C)C4CCOCC4

InChI

InChI=1S/C23H26FN3O/c1-17-5-3-8-22(13-17)27-16-19(15-26(2)21-9-11-28-12-10-21)23(25-27)18-6-4-7-20(24)14-18/h3-8,13-14,16,21H,9-12,15H2,1-2H3/p+1