[2-naphthalen-1-yl-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [2-naphthalen-1-yl-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; [2-(1-naphthyl)-3-tetrahydrofuran-2-yl-propyl]-(2-piperidin-1-ium-1-ylethyl)ammonium CAS Name: 2-hydroxy-2-oxoacetate; [2-(1-naphthalenyl)-3-(2-oxolanyl)propyl]-[2-(1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: 2-hydroxy-2-oxoacetate; [2-naphthalen-1-yl-3-(oxolan-2-yl)propyl]-(2-piperidin-1-ium-1-ylethyl)azanium Traditional Name: [2-(1-naphthyl)-3-(tetrahydrofuryl)propyl]-(2-piperidin-1-ium-1-ylethyl)ammonium dibinoxalate Formula: C28H38N2O9 MolecularWeight: 546.60932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC[NH2+]CC(CC2CCCO2)C3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

Isomeric SMILES

C1CC[NH+](CC1)CC[NH2+]CC(CC2CCCO2)C3=CC=CC4=CC=CC=C43.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C24H34N2O.2C2H2O4/c1-4-14-26(15-5-1)16-13-25-19-21(18-22-10-7-17-27-22)24-12-6-9-20-8-2-3-11-23(20)24;2*3-1(4)2(5)6/h2-3,6,8-9,11-12,21-22,25H,1,4-5,7,10,13-19H2;2*(H,3,4)(H,5,6)