[5-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-propyl)-2-methoxy-phenyl]methyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [5-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-propyl)-2-methoxy-phenyl]methyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: [5-(3-ethoxy-2-ethoxycarbonyl-3-oxo-propyl)-2-methoxy-phenyl]methyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: [5-(3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2-methoxyphenyl]methyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: [5-(3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2-methoxyphenyl]methyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: [5-(2-carbethoxy-3-ethoxy-3-keto-propyl)-2-methoxy-benzyl]-dimethyl-ammonium binoxalate Formula: C20H29NO9 MolecularWeight: 427.44556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C=C1)OC)C[NH+](C)C)C(=O)OCC.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C=C1)OC)C[NH+](C)C)C(=O)OCC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C18H27NO5.C2H2O4/c1-6-23-17(20)15(18(21)24-7-2)11-13-8-9-16(22-5)14(10-13)12-19(3)4;3-1(4)2(5)6/h8-10,15H,6-7,11-12H2,1-5H3;(H,3,4)(H,5,6)