N-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[[3-(4-chlorophenyl)isoxazol-5-yl]methyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[[3-(4-chlorophenyl)-5-isoxazolyl]methyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[[3-(4-chlorophenyl)isoxazol-5-yl]methyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C16H19ClN3O2+ MolecularWeight: 320.79396

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NCC2=CC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NCC2=CC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN3O2/c17-13-5-3-12(4-6-13)15-9-14(22-19-15)10-18-16(21)11-20-7-1-2-8-20/h3-6,9H,1-2,7-8,10-11H2,(H,18,21)/p+1