1-(4-methyl-4-prop-2-enyl-piperazin-4-ium-1-yl)decan-1-one bromide

Systemtic Name: 1-(4-methyl-4-prop-2-enyl-piperazin-4-ium-1-yl)decan-1-one bromide Openeye Name: 1-(4-allyl-4-methyl-piperazin-4-ium-1-yl)decan-1-one bromide CAS Name: 1-(4-methyl-4-prop-2-enyl-1-piperazin-4-iumyl)-1-decanone bromide IUPAC Name: 1-(4-methyl-4-prop-2-enylpiperazin-4-ium-1-yl)decan-1-one bromide Traditional Name: 1-(4-allyl-4-methyl-piperazin-4-ium-1-yl)decan-1-one bromide Formula: C18H35BrN2O MolecularWeight: 375.3873

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)N1CC[N+](CC1)(C)CC=C.[Br-]

Isomeric SMILES

CCCCCCCCCC(=O)N1CC[N+](CC1)(C)CC=C.[Br-]

InChI

InChI=1S/C18H35N2O.BrH/c1-4-6-7-8-9-10-11-12-18(21)19-13-16-20(3,15-5-2)17-14-19;/h5H,2,4,6-17H2,1,3H3;1H/q+1;/p-1