3-(4,4-dimethylpiperazin-4-ium-1-yl)aniline bromide

Systemtic Name: 3-(4,4-dimethylpiperazin-4-ium-1-yl)aniline bromide Openeye Name: 3-(4,4-dimethylpiperazin-4-ium-1-yl)aniline bromide CAS Name: 3-(4,4-dimethyl-1-piperazin-4-iumyl)aniline bromide IUPAC Name: 3-(4,4-dimethylpiperazin-4-ium-1-yl)aniline bromide Traditional Name: [3-(4,4-dimethylpiperazin-4-ium-1-yl)phenyl]amine bromide Formula: C12H20BrN3 MolecularWeight: 286.2113

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2=CC(=CC=C2)N)C.[Br-]

Isomeric SMILES

C[N+]1(CCN(CC1)C2=CC(=CC=C2)N)C.[Br-]

InChI

InChI=1S/C12H20N3.BrH/c1-15(2)8-6-14(7-9-15)12-5-3-4-11(13)10-12;/h3-5,10H,6-9,13H2,1-2H3;1H/q+1;/p-1