1-[4-(3-bromanylphenoxy)butyl]-4-ethyl-piperazin-1-ium

Systemtic Name: 1-[4-(3-bromanylphenoxy)butyl]-4-ethyl-piperazin-1-ium Openeye Name: 1-[4-(3-bromophenoxy)butyl]-4-ethyl-piperazin-1-ium CAS Name: 1-[4-(3-bromophenoxy)butyl]-4-ethylpiperazin-1-ium IUPAC Name: 1-[4-(3-bromophenoxy)butyl]-4-ethylpiperazin-1-ium Traditional Name: 1-[4-(3-bromophenoxy)butyl]-4-ethyl-piperazin-1-ium Formula: C16H26BrN2O+ MolecularWeight: 342.29444

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CCCCOC2=CC(=CC=C2)Br

Isomeric SMILES

CCN1CC[NH+](CC1)CCCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H25BrN2O/c1-2-18-9-11-19(12-10-18)8-3-4-13-20-16-7-5-6-15(17)14-16/h5-7,14H,2-4,8-13H2,1H3/p+1