(4-azanyl-3-phenyl-quinolin-2-yl)-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: (4-azanyl-3-phenyl-quinolin-2-yl)-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: (4-amino-3-phenyl-2-quinolyl)-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: (4-amino-3-phenyl-2-quinolinyl)-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: (4-amino-3-phenylquinolin-2-yl)-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: (4-amino-3-phenyl-2-quinolyl)-dimethyl-ammonium binoxalate Formula: C19H19N3O4 MolecularWeight: 353.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1=NC2=CC=CC=C2C(=C1C3=CC=CC=C3)N.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+](C)C1=NC2=CC=CC=C2C(=C1C3=CC=CC=C3)N.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C17H17N3.C2H2O4/c1-20(2)17-15(12-8-4-3-5-9-12)16(18)13-10-6-7-11-14(13)19-17;3-1(4)2(5)6/h3-11H,1-2H3,(H2,18,19);(H,3,4)(H,5,6)