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

Systemtic Name: (3-bromophenyl)methyl-[2-(dimethylazaniumyl)ethyl]-ethyl-azanium Openeye Name: (3-bromophenyl)methyl-[2-(dimethylammonio)ethyl]-ethyl-ammonium CAS Name: (3-bromophenyl)methyl-[2-(dimethylammonio)ethyl]-ethylammonium IUPAC Name: (3-bromophenyl)methyl-[2-(dimethylazaniumyl)ethyl]-ethylazanium Traditional Name: (3-bromobenzyl)-[2-(dimethylammonio)ethyl]-ethyl-ammonium Formula: C13H23BrN2+2 MolecularWeight: 287.23912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21BrN2/c1-4-16(9-8-15(2)3)11-12-6-5-7-13(14)10-12/h5-7,10H,4,8-9,11H2,1-3H3/p+2