2-[[4,7-dimethoxy-5-[3-(4-methoxyphenyl)-1-oxidanyl-propyl]-1-benzofuran-6-yl]oxy]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-[[4,7-dimethoxy-5-[3-(4-methoxyphenyl)-1-oxidanyl-propyl]-1-benzofuran-6-yl]oxy]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-[5-[1-hydroxy-3-(4-methoxyphenyl)propyl]-4,7-dimethoxy-benzofuran-6-yl]oxyethyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-[[5-[1-hydroxy-3-(4-methoxyphenyl)propyl]-4,7-dimethoxy-6-benzofuranyl]oxy]ethyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-[[5-[1-hydroxy-3-(4-methoxyphenyl)propyl]-4,7-dimethoxy-1-benzofuran-6-yl]oxy]ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-[5-[1-hydroxy-3-(4-methoxyphenyl)propyl]-4,7-dimethoxy-benzofuran-6-yl]oxyethyl-dimethyl-ammonium binoxalate Formula: C26H33NO10 MolecularWeight: 519.54092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(CCC3=CC=C(C=C3)OC)O)OC)OC.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(CCC3=CC=C(C=C3)OC)O)OC)OC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C24H31NO6.C2H2O4/c1-25(2)13-15-31-23-20(19(26)11-8-16-6-9-17(27-3)10-7-16)21(28-4)18-12-14-30-22(18)24(23)29-5;3-1(4)2(5)6/h6-7,9-10,12,14,19,26H,8,11,13,15H2,1-5H3;(H,3,4)(H,5,6)