1-[3-(3-bromanylphenoxy)propyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[3-(3-bromanylphenoxy)propyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(3-bromophenoxy)propyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-(3-bromophenoxy)propyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(3-bromophenoxy)propyl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-(3-bromophenoxy)propyl]-4-methyl-piperazin-4-ium Formula: C14H22BrN2O+ MolecularWeight: 314.24128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[NH+]1CCN(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+1