(3-bromophenyl)methyl-[2-(dimethylazaniumyl)ethyl]-(phenylmethyl)azanium

Systemtic Name: (3-bromophenyl)methyl-[2-(dimethylazaniumyl)ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(3-bromophenyl)methyl]-[2-(dimethylammonio)ethyl]ammonium CAS Name: (3-bromophenyl)methyl-[2-(dimethylammonio)ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3-bromophenyl)methyl]-[2-(dimethylazaniumyl)ethyl]azanium Traditional Name: benzyl-(3-bromobenzyl)-[2-(dimethylammonio)ethyl]ammonium Formula: C18H25BrN2+2 MolecularWeight: 349.3085

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH+](CC1=CC=CC=C1)CC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+](C)CC[NH+](CC1=CC=CC=C1)CC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H23BrN2/c1-20(2)11-12-21(14-16-7-4-3-5-8-16)15-17-9-6-10-18(19)13-17/h3-10,13H,11-12,14-15H2,1-2H3/p+2