2-[4-[[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[[3-(2-methoxyphenyl)isoxazol-5-yl]methyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[[3-(2-methoxyphenyl)-5-isoxazolyl]methyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl]piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[[3-(2-methoxyphenyl)isoxazol-5-yl]methyl]piperazin-1-ium-1-yl]acetamide Formula: C20H27N4O3+ MolecularWeight: 371.45338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)CN3CC[NH+](CC3)CC(=O)NCC=C

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)CN3CC[NH+](CC3)CC(=O)NCC=C

InChI

InChI=1S/C20H26N4O3/c1-3-8-21-20(25)15-24-11-9-23(10-12-24)14-16-13-18(22-27-16)17-6-4-5-7-19(17)26-2/h3-7,13H,1,8-12,14-15H2,2H3,(H,21,25)/p+1