[1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]methylazanium

Systemtic Name: [1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]methylazanium Openeye Name: [1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]methylammonium CAS Name: [1-[(3-bromophenyl)methyl]-4-piperidin-1-iumyl]methylammonium IUPAC Name: [1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]methylazanium Traditional Name: [1-(3-bromobenzyl)piperidin-1-ium-4-yl]methylammonium Formula: C13H21BrN2+2 MolecularWeight: 285.22324

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C[NH3+])CC2=CC(=CC=C2)Br

Isomeric SMILES

C1C[NH+](CCC1C[NH3+])CC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H19BrN2/c14-13-3-1-2-12(8-13)10-16-6-4-11(9-15)5-7-16/h1-3,8,11H,4-7,9-10,15H2/p+2