3-[1,4-bis(2-tetradecoxyethyl)piperazin-1-ium-1-yl]propan-1-amine bromide

Systemtic Name: 3-[1,4-bis(2-tetradecoxyethyl)piperazin-1-ium-1-yl]propan-1-amine bromide Openeye Name: 3-[1,4-bis(2-tetradecoxyethyl)piperazin-1-ium-1-yl]propan-1-amine bromide CAS Name: 3-[1,4-bis(2-tetradecoxyethyl)-1-piperazin-1-iumyl]-1-propanamine bromide IUPAC Name: 3-[1,4-bis(2-tetradecoxyethyl)piperazin-1-ium-1-yl]propan-1-amine bromide Traditional Name: 3-[1,4-bis(2-myristyloxyethyl)piperazin-1-ium-1-yl]propylamine bromide Formula: C39H82BrN3O2 MolecularWeight: 704.99128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOCCN1CC[N+](CC1)(CCCN)CCOCCCCCCCCCCCCCC.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOCCN1CC[N+](CC1)(CCCN)CCOCCCCCCCCCCCCCC.[Br-]

InChI

InChI=1S/C39H82N3O2.BrH/c1-3-5-7-9-11-13-15-17-19-21-23-25-36-43-38-31-41-29-33-42(34-30-41,32-27-28-40)35-39-44-37-26-24-22-20-18-16-14-12-10-8-6-4-2;/h3-40H2,1-2H3;1H/q+1;/p-1