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

Systemtic Name: (2-bromophenyl)methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: (2-bromophenyl)methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: (2-bromophenyl)methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (2-bromophenyl)methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: (2-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=C2Br

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+]CC2=CC=CC=C2Br

InChI

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