2-naphthalen-1-ylpent-4-enyl(2-piperidin-1-ium-1-ylethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-naphthalen-1-ylpent-4-enyl(2-piperidin-1-ium-1-ylethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; 2-(1-naphthyl)pent-4-enyl-(2-piperidin-1-ium-1-ylethyl)ammonium CAS Name: 2-hydroxy-2-oxoacetate; 2-(1-naphthalenyl)pent-4-enyl-[2-(1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: 2-hydroxy-2-oxoacetate; 2-naphthalen-1-ylpent-4-enyl(2-piperidin-1-ium-1-ylethyl)azanium Traditional Name: 2-(1-naphthyl)pent-4-enyl-(2-piperidin-1-ium-1-ylethyl)ammonium dibinoxalate Formula: C26H34N2O8 MolecularWeight: 502.55676

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C[NH2+]CC[NH+]1CCCCC1)C2=CC=CC3=CC=CC=C32.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

Isomeric SMILES

C=CCC(C[NH2+]CC[NH+]1CCCCC1)C2=CC=CC3=CC=CC=C32.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C22H30N2.2C2H2O4/c1-2-9-20(18-23-14-17-24-15-6-3-7-16-24)22-13-8-11-19-10-4-5-12-21(19)22;2*3-1(4)2(5)6/h2,4-5,8,10-13,20,23H,1,3,6-7,9,14-18H2;2*(H,3,4)(H,5,6)