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

Systemtic Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-phenyl-isoxazole CAS Name: 3-[[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-5-phenylisoxazole IUPAC Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-phenyl-isoxazole Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2/c1-25-20-9-5-8-19(15-20)24-12-10-23(11-13-24)16-18-14-21(26-22-18)17-6-3-2-4-7-17/h2-9,14-15H,10-13,16H2,1H3/p+1