diethyl-[6-[(4-methyl-3-phenyl-phenyl)azaniumyl]hexyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: diethyl-[6-[(4-methyl-3-phenyl-phenyl)azaniumyl]hexyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: diethyl-[6-[(4-methyl-3-phenyl-phenyl)ammonio]hexyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: diethyl-[6-[(4-methyl-3-phenylphenyl)ammonio]hexyl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: diethyl-[6-[(4-methyl-3-phenylphenyl)azaniumyl]hexyl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: diethyl-[6-[(4-methyl-3-phenyl-phenyl)ammonio]hexyl]ammonium dibinoxalate Formula: C27H38N2O8 MolecularWeight: 518.59922

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCCCC[NH2+]C1=CC(=C(C=C1)C)C2=CC=CC=C2.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC[NH+](CC)CCCCCC[NH2+]C1=CC(=C(C=C1)C)C2=CC=CC=C2.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C23H34N2.2C2H2O4/c1-4-25(5-2)18-12-7-6-11-17-24-22-16-15-20(3)23(19-22)21-13-9-8-10-14-21;2*3-1(4)2(5)6/h8-10,13-16,19,24H,4-7,11-12,17-18H2,1-3H3;2*(H,3,4)(H,5,6)