[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(1,2-oxazol-5-ylmethyl)azanium

Systemtic Name: [3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(1,2-oxazol-5-ylmethyl)azanium Openeye Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-(isoxazol-5-ylmethyl)-methyl-ammonium CAS Name: [3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-(5-isoxazolylmethyl)-methylammonium IUPAC Name: [3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl-methyl-(1,2-oxazol-5-ylmethyl)azanium Traditional Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-(isoxazol-5-ylmethyl)-methyl-ammonium Formula: C22H22FN4O2+ MolecularWeight: 393.434083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=NO1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CC=NO1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

InChI

InChI=1S/C22H21FN4O2/c1-26(15-19-10-11-24-29-19)13-16-14-27(17-6-4-3-5-7-17)25-22(16)20-9-8-18(28-2)12-21(20)23/h3-12,14H,13,15H2,1-2H3/p+1