5-methyl-1-[4-(1-methylaziridin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one bromide

Systemtic Name: 5-methyl-1-[4-(1-methylaziridin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one bromide Openeye Name: 5-methyl-1-[4-(1-methylaziridin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one bromide CAS Name: 5-methyl-1-[4-(1-methyl-1-aziridin-1-iumyl)but-2-ynyl]-2-pyrrolidinone bromide IUPAC Name: 5-methyl-1-[4-(1-methylaziridin-1-ium-1-yl)but-2-ynyl]pyrrolidin-2-one bromide Traditional Name: 5-methyl-1-[4-(1-methylethylenimin-1-ium-1-yl)but-2-ynyl]-2-pyrrolidone bromide Formula: C12H19BrN2O MolecularWeight: 287.19606

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)N1CC#CC[N+]2(CC2)C.[Br-]

Isomeric SMILES

CC1CCC(=O)N1CC#CC[N+]2(CC2)C.[Br-]

InChI

InChI=1S/C12H19N2O.BrH/c1-11-5-6-12(15)13(11)7-3-4-8-14(2)9-10-14;/h11H,5-10H2,1-2H3;1H/q+1;/p-1