dibutyl-[4-[2-oxidanylidene-5-(propoxymethyl)oxolan-3-yl]but-2-ynyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: dibutyl-[4-[2-oxidanylidene-5-(propoxymethyl)oxolan-3-yl]but-2-ynyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: dibutyl-[4-[2-oxo-5-(propoxymethyl)tetrahydrofuran-3-yl]but-2-ynyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: dibutyl-[4-[2-oxo-5-(propoxymethyl)-3-oxolanyl]but-2-ynyl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: dibutyl-[4-[2-oxo-5-(propoxymethyl)oxolan-3-yl]but-2-ynyl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: dibutyl-[4-[2-keto-5-(propoxymethyl)tetrahydrofuran-3-yl]but-2-ynyl]ammonium binoxalate Formula: C22H37NO7 MolecularWeight: 427.53168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC#CCC1CC(OC1=O)COCCC.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCCC[NH+](CCCC)CC#CCC1CC(OC1=O)COCCC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C20H35NO3.C2H2O4/c1-4-7-12-21(13-8-5-2)14-10-9-11-18-16-19(24-20(18)22)17-23-15-6-3;3-1(4)2(5)6/h18-19H,4-8,11-17H2,1-3H3;(H,3,4)(H,5,6)