1-[4-(4-bromanylphenoxy)butyl]-4-methyl-piperazin-1-ium

Systemtic Name: 1-[4-(4-bromanylphenoxy)butyl]-4-methyl-piperazin-1-ium Openeye Name: 1-[4-(4-bromophenoxy)butyl]-4-methyl-piperazin-1-ium CAS Name: 1-[4-(4-bromophenoxy)butyl]-4-methylpiperazin-1-ium IUPAC Name: 1-[4-(4-bromophenoxy)butyl]-4-methylpiperazin-1-ium Traditional Name: 1-[4-(4-bromophenoxy)butyl]-4-methyl-piperazin-1-ium Formula: C15H24BrN2O+ MolecularWeight: 328.26786

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)Br

Isomeric SMILES

CN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H23BrN2O/c1-17-9-11-18(12-10-17)8-2-3-13-19-15-6-4-14(16)5-7-15/h4-7H,2-3,8-13H2,1H3/p+1