(4-dimethylaminophenyl)methyl-(pyridin-2-ylmethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: (4-dimethylaminophenyl)methyl-(pyridin-2-ylmethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: (4-dimethylaminophenyl)methyl-(2-pyridylmethyl)ammonium; 2-hydroxy-2-oxo-acetate CAS Name: (4-dimethylaminophenyl)methyl-(2-pyridinylmethyl)ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: (4-dimethylaminophenyl)methyl-(pyridin-2-ylmethyl)azanium; 2-hydroxy-2-oxoacetate Traditional Name: [4-(dimethylamino)benzyl]-(2-pyridylmethyl)ammonium binoxalate Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C[NH2+]CC2=CC=CC=N2.C(=O)(C(=O)[O-])O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C[NH2+]CC2=CC=CC=N2.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C15H19N3.C2H2O4/c1-18(2)15-8-6-13(7-9-15)11-16-12-14-5-3-4-10-17-14;3-1(4)2(5)6/h3-10,16H,11-12H2,1-2H3;(H,3,4)(H,5,6)