1-(furan-2-yl)but-3-enyl-phenethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 1-(furan-2-yl)but-3-enyl-phenethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 1-(2-furyl)but-3-enyl-phenethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 1-(2-furanyl)but-3-enyl-phenethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 1-(furan-2-yl)but-3-enyl-phenethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 1-(2-furyl)but-3-enyl-phenethyl-ammonium binoxalate Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1=CC=CO1)[NH2+]CCC2=CC=CC=C2.C(=O)(C(=O)[O-])O

Isomeric SMILES

C=CCC(C1=CC=CO1)[NH2+]CCC2=CC=CC=C2.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C16H19NO.C2H2O4/c1-2-7-15(16-10-6-13-18-16)17-12-11-14-8-4-3-5-9-14;3-1(4)2(5)6/h2-6,8-10,13,15,17H,1,7,11-12H2;(H,3,4)(H,5,6)