3-bromanylpropyl-[(2-bromophenyl)methyl]-ethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 3-bromanylpropyl-[(2-bromophenyl)methyl]-ethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: (2-bromophenyl)methyl-(3-bromopropyl)-ethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: (2-bromophenyl)methyl-(3-bromopropyl)-ethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: (2-bromophenyl)methyl-(3-bromopropyl)-ethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: (2-bromobenzyl)-(3-bromopropyl)-ethyl-ammonium binoxalate Formula: C14H19Br2NO4 MolecularWeight: 425.11296

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCBr)CC1=CC=CC=C1Br.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC[NH+](CCCBr)CC1=CC=CC=C1Br.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C12H17Br2N.C2H2O4/c1-2-15(9-5-8-13)10-11-6-3-4-7-12(11)14;3-1(4)2(5)6/h3-4,6-7H,2,5,8-10H2,1H3;(H,3,4)(H,5,6)