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

Systemtic Name: [1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]-methyl-ammonium CAS Name: [1-[(3-bromophenyl)methyl]-4-piperidin-1-iumyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[1-[(3-bromophenyl)methyl]piperidin-1-ium-4-yl]-methylazanium Traditional Name: benzyl-[1-(3-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(=CC=C3)Br

Isomeric SMILES

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

InChI

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