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

Systemtic Name: 3-(2-methoxyphenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,2-oxazole Openeye Name: 3-(2-methoxyphenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]isoxazole CAS Name: 3-(2-methoxyphenyl)-5-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]isoxazole IUPAC Name: 3-(2-methoxyphenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,2-oxazole Traditional Name: 3-(2-methoxyphenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]isoxazole Formula: C22H26N3O3+ MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C22H25N3O3/c1-26-21-9-5-3-7-18(21)19-15-17(28-23-19)16-24-11-13-25(14-12-24)20-8-4-6-10-22(20)27-2/h3-10,15H,11-14,16H2,1-2H3/p+1