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

Systemtic Name: 1-[3-(3-bromanylphenoxy)propyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[3-(3-bromophenoxy)propyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[3-(3-bromophenoxy)propyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[3-(3-bromophenoxy)propyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[3-(3-bromophenoxy)propyl]-4-methyl-piperazine-1,4-diium Formula: C14H23BrN2O+2 MolecularWeight: 315.24922

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCOC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H21BrN2O/c1-16-7-9-17(10-8-16)6-3-11-18-14-5-2-4-13(15)12-14/h2,4-5,12H,3,6-11H2,1H3/p+2