2-[[(4-chlorophenyl)-phenyl-methyl]azaniumyl]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-[[(4-chlorophenyl)-phenyl-methyl]azaniumyl]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-[[(4-chlorophenyl)-phenyl-methyl]ammonio]ethyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-[[(4-chlorophenyl)-phenylmethyl]ammonio]ethyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-[[(4-chlorophenyl)-phenylmethyl]azaniumyl]ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-[[(4-chlorophenyl)-phenyl-methyl]ammonio]ethyl-dimethyl-ammonium dibinoxalate Formula: C21H25ClN2O8 MolecularWeight: 468.8848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClN2.2C2H2O4/c1-20(2)13-12-19-17(14-6-4-3-5-7-14)15-8-10-16(18)11-9-15;2*3-1(4)2(5)6/h3-11,17,19H,12-13H2,1-2H3;2*(H,3,4)(H,5,6)