(5-bromanylfuran-2-yl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: (5-bromanylfuran-2-yl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: (5-bromo-2-furyl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: (5-bromo-2-furanyl)methyl-[3-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: (5-bromofuran-2-yl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: (5-bromo-2-furyl)methyl-[3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C13H24BrN3O+2 MolecularWeight: 318.25316

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCC[NH2+]CC2=CC=C(O2)Br

Isomeric SMILES

C[NH+]1CCN(CC1)CCC[NH2+]CC2=CC=C(O2)Br

InChI

InChI=1S/C13H22BrN3O/c1-16-7-9-17(10-8-16)6-2-5-15-11-12-3-4-13(14)18-12/h3-4,15H,2,5-11H2,1H3/p+2