4-[3-(1,1-dimethylpiperidin-1-ium-3-yl)prop-2-ynyl]-4-methyl-morpholin-4-ium bromide

Systemtic Name: 4-[3-(1,1-dimethylpiperidin-1-ium-3-yl)prop-2-ynyl]-4-methyl-morpholin-4-ium bromide Openeye Name: 4-[3-(1,1-dimethylpiperidin-1-ium-3-yl)prop-2-ynyl]-4-methyl-morpholin-4-ium bromide CAS Name: 4-[3-(1,1-dimethyl-3-piperidin-1-iumyl)prop-2-ynyl]-4-methylmorpholin-4-ium bromide IUPAC Name: 4-[3-(1,1-dimethylpiperidin-1-ium-3-yl)prop-2-ynyl]-4-methylmorpholin-4-ium bromide Traditional Name: 4-[3-(1,1-dimethylpiperidin-1-ium-3-yl)prop-2-ynyl]-4-methyl-morpholin-4-ium bromide Formula: C15H28BrN2O+ MolecularWeight: 332.29962

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC(C1)C#CC[N+]2(CCOCC2)C)C.[Br-]

Isomeric SMILES

C[N+]1(CCCC(C1)C#CC[N+]2(CCOCC2)C)C.[Br-]

InChI

InChI=1S/C15H28N2O.BrH/c1-16(2)8-4-6-15(14-16)7-5-9-17(3)10-12-18-13-11-17;/h15H,4,6,8-14H2,1-3H3;1H/q+2;/p-1