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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)Br)C[NH3+]

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)Br)C[NH3+]

InChI

InChI=1S/C13H19BrN2/c14-13-5-3-11(4-6-13)9-16-7-1-2-12(8-15)10-16/h3-6,12H,1-2,7-10,15H2/p+2/t12-/m1/s1