5-(4-fluorophenyl)-4-methyl-3-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2-oxazole

Systemtic Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2-oxazole Openeye Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]isoxazole CAS Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(2-methylphenyl)-1-piperazin-1-iumyl]methyl]isoxazole IUPAC Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2-oxazole Traditional Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]isoxazole Formula: C22H25FN3O+ MolecularWeight: 366.451803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=NOC(=C3C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=NOC(=C3C)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O/c1-16-5-3-4-6-21(16)26-13-11-25(12-14-26)15-20-17(2)22(27-24-20)18-7-9-19(23)10-8-18/h3-10H,11-15H2,1-2H3/p+1