[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl-methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl-methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C19H29FN4O2+2 MolecularWeight: 364.457563

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC[NH+]1CCOCC1)CC2=C(NN=C2)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

C[NH+](CCC[NH+]1CCOCC1)CC2=C(NN=C2)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C19H27FN4O2/c1-23(6-3-7-24-8-10-26-11-9-24)14-16-13-21-22-19(16)15-4-5-18(25-2)17(20)12-15/h4-5,12-13H,3,6-11,14H2,1-2H3,(H,21,22)/p+2