1-[1-(5-bicyclo[2.2.1]hept-2-enylmethyl)piperidin-4-yl]-4-methyl-piperazin-4-ium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 1-[1-(5-bicyclo[2.2.1]hept-2-enylmethyl)piperidin-4-yl]-4-methyl-piperazin-4-ium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 1-[1-(5-bicyclo[2.2.1]hept-2-enylmethyl)-4-piperidyl]-4-methyl-piperazin-4-ium; 2-hydroxy-2-oxo-acetate CAS Name: 1-[1-(5-bicyclo[2.2.1]hept-2-enylmethyl)-4-piperidinyl]-4-methylpiperazin-4-ium; 2-hydroxy-2-oxoacetate IUPAC Name: 1-[1-(5-bicyclo[2.2.1]hept-2-enylmethyl)piperidin-4-yl]-4-methylpiperazin-4-ium; 2-hydroxy-2-oxoacetate Traditional Name: 1-[1-(5-bicyclo[2.2.1]hept-2-enylmethyl)-4-piperidyl]-4-methyl-piperazin-4-ium binoxalate Formula: C20H33N3O4 MolecularWeight: 379.49372

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2CCN(CC2)CC3CC4CC3C=C4.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+]1CCN(CC1)C2CCN(CC2)CC3CC4CC3C=C4.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C18H31N3.C2H2O4/c1-19-8-10-21(11-9-19)18-4-6-20(7-5-18)14-17-13-15-2-3-16(17)12-15;3-1(4)2(5)6/h2-3,15-18H,4-14H2,1H3;(H,3,4)(H,5,6)