1-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)docosan-1-one

Systemtic Name: 1-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)docosan-1-one Openeye Name: 1-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)docosan-1-one CAS Name: 1-(4-ethyl-4-methyl-1-piperazin-4-iumyl)-1-docosanone IUPAC Name: 1-(4-ethyl-4-methylpiperazin-4-ium-1-yl)docosan-1-one Traditional Name: 1-(4-ethyl-4-methyl-piperazin-4-ium-1-yl)docosan-1-one Formula: C29H59N2O+ MolecularWeight: 451.79156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)N1CC[N+](CC1)(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)N1CC[N+](CC1)(C)CC

InChI

InChI=1S/C29H59N2O/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-29(32)30-25-27-31(3,5-2)28-26-30/h4-28H2,1-3H3/q+1