2-(2,2-dimethyl-6-pentyl-chromen-7-yl)oxyethyl-diethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-(2,2-dimethyl-6-pentyl-chromen-7-yl)oxyethyl-diethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-(2,2-dimethyl-6-pentyl-chromen-7-yl)oxyethyl-diethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-[(2,2-dimethyl-6-pentyl-1-benzopyran-7-yl)oxy]ethyl-diethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-(2,2-dimethyl-6-pentylchromen-7-yl)oxyethyl-diethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-(6-amyl-2,2-dimethyl-chromen-7-yl)oxyethyl-diethyl-ammonium binoxalate Formula: C24H37NO6 MolecularWeight: 435.55368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C2C(=C1)C=CC(O2)(C)C)OCC[NH+](CC)CC.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCCCCC1=C(C=C2C(=C1)C=CC(O2)(C)C)OCC[NH+](CC)CC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C22H35NO2.C2H2O4/c1-6-9-10-11-18-16-19-12-13-22(4,5)25-21(19)17-20(18)24-15-14-23(7-2)8-3;3-1(4)2(5)6/h12-13,16-17H,6-11,14-15H2,1-5H3;(H,3,4)(H,5,6)