[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-methyl-ammonium CAS Name: [1-[(4-bromophenyl)methyl]-4-piperidin-1-iumyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-methylazanium Traditional Name: benzyl-[1-(4-bromobenzyl)piperidin-1-ium-4-yl]-methyl-ammonium Formula: C20H27BrN2+2 MolecularWeight: 375.34578

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2CC[NH+](CC2)CC3=CC=C(C=C3)Br

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2CC[NH+](CC2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H25BrN2/c1-22(15-17-5-3-2-4-6-17)20-11-13-23(14-12-20)16-18-7-9-19(21)10-8-18/h2-10,20H,11-16H2,1H3/p+2