(3-bromophenyl)methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3-bromophenyl)methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: (3-bromophenyl)methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: (3-bromophenyl)methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3-bromophenyl)methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: (3-bromobenzyl)-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C13H21BrN2+2 MolecularWeight: 285.22324

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H19BrN2/c1-16-7-5-13(6-8-16)15-10-11-3-2-4-12(14)9-11/h2-4,9,13,15H,5-8,10H2,1H3/p+2