4-[[3-(3-fluoranyl-4-methoxy-phenyl)-1-(2-methylphenyl)pyrazol-4-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[3-(3-fluoranyl-4-methoxy-phenyl)-1-(2-methylphenyl)pyrazol-4-yl]methyl]morpholin-4-ium Openeye Name: 4-[[3-(3-fluoro-4-methoxy-phenyl)-1-(o-tolyl)pyrazol-4-yl]methyl]morpholin-4-ium CAS Name: 4-[[3-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)-4-pyrazolyl]methyl]morpholin-4-ium IUPAC Name: 4-[[3-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)pyrazol-4-yl]methyl]morpholin-4-ium Traditional Name: 4-[[3-(3-fluoro-4-methoxy-phenyl)-1-(o-tolyl)pyrazol-4-yl]methyl]morpholin-4-ium Formula: C22H25FN3O2+ MolecularWeight: 382.451203

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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+]4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C(=N2)C3=CC(=C(C=C3)OC)F)C[NH+]4CCOCC4

InChI

InChI=1S/C22H24FN3O2/c1-16-5-3-4-6-20(16)26-15-18(14-25-9-11-28-12-10-25)22(24-26)17-7-8-21(27-2)19(23)13-17/h3-8,13,15H,9-12,14H2,1-2H3/p+1