4-dodecyl-N,N-diethyl-4-methyl-piperazin-4-ium-1-carboxamide bromide

Systemtic Name: 4-dodecyl-N,N-diethyl-4-methyl-piperazin-4-ium-1-carboxamide bromide Openeye Name: 4-dodecyl-N,N-diethyl-4-methyl-piperazin-4-ium-1-carboxamide bromide CAS Name: 4-dodecyl-N,N-diethyl-4-methyl-1-piperazin-4-iumcarboxamide bromide IUPAC Name: 4-dodecyl-N,N-diethyl-4-methylpiperazin-4-ium-1-carboxamide bromide Traditional Name: N,N-diethyl-4-lauryl-4-methyl-piperazin-4-ium-1-carboxamide bromide Formula: C22H46BrN3O MolecularWeight: 448.52414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1(CCN(CC1)C(=O)N(CC)CC)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCC[N+]1(CCN(CC1)C(=O)N(CC)CC)C.[Br-]

InChI

InChI=1S/C22H46N3O.BrH/c1-5-8-9-10-11-12-13-14-15-16-19-25(4)20-17-24(18-21-25)22(26)23(6-2)7-3;/h5-21H2,1-4H3;1H/q+1;/p-1