2-[(4-chlorophenyl)-pyridin-3-yl-methylidene]azaniumyloxyethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-[(4-chlorophenyl)-pyridin-3-yl-methylidene]azaniumyloxyethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-[(4-chlorophenyl)-(3-pyridyl)methylene]ammoniooxyethyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-[(4-chlorophenyl)-(3-pyridinyl)methylidene]ammoniooxyethyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-[(4-chlorophenyl)-pyridin-3-ylmethylidene]azaniumyloxyethyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-[(4-chlorophenyl)-(3-pyridyl)methylene]ammoniooxyethyl-dimethyl-ammonium dibinoxalate Formula: C20H22ClN3O9 MolecularWeight: 483.85638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[NH+](C)CCO/[NH+]=C(\C1=CC=C(C=C1)Cl)/C2=CN=CC=C2.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C16H18ClN3O.2C2H2O4/c1-20(2)10-11-21-19-16(14-4-3-9-18-12-14)13-5-7-15(17)8-6-13;2*3-1(4)2(5)6/h3-9,12H,10-11H2,1-2H3;2*(H,3,4)(H,5,6)/b19-16+;;