(2-bromophenyl)methyl-(6-chloranylhexyl)-ethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: (2-bromophenyl)methyl-(6-chloranylhexyl)-ethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: (2-bromophenyl)methyl-(6-chlorohexyl)-ethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: (2-bromophenyl)methyl-(6-chlorohexyl)-ethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: (2-bromophenyl)methyl-(6-chlorohexyl)-ethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: (2-bromobenzyl)-(6-chlorohexyl)-ethyl-ammonium binoxalate Formula: C17H25BrClNO4 MolecularWeight: 422.7417

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23BrClN.C2H2O4/c1-2-18(12-8-4-3-7-11-17)13-14-9-5-6-10-15(14)16;3-1(4)2(5)6/h5-6,9-10H,2-4,7-8,11-13H2,1H3;(H,3,4)(H,5,6)