1-[4-(3-bromanylphenoxy)butyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[4-(3-bromanylphenoxy)butyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[4-(3-bromophenoxy)butyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[4-(3-bromophenoxy)butyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[4-(3-bromophenoxy)butyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[4-(3-bromophenoxy)butyl]-4-methyl-piperazine-1,4-diium Formula: C15H25BrN2O+2 MolecularWeight: 329.2758

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCCOC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCCOC2=CC(=CC=C2)Br

InChI

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