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2-oxidanyl-2-oxidanylidene-ethanoate; piperidin-1-yl-[1-(pyridin-4-ylmethyl)piperidin-1-ium-3-yl]methanone

2-oxidanyl-2-oxidanylidene-ethanoate; piperidin-1-yl-[1-(pyridin-4-ylmethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name:2-oxidanyl-2-oxidanylidene-ethanoate; piperidin-1-yl-[1-(pyridin-4-ylmethyl)piperidin-1-ium-3-yl]methanone
Openeye Name:2-hydroxy-2-oxo-acetate; 1-piperidyl-[1-(4-pyridylmethyl)piperidin-1-ium-3-yl]methanone
CAS Name:2-hydroxy-2-oxoacetate; 1-piperidinyl-[1-(pyridin-4-ylmethyl)-3-piperidin-1-iumyl]methanone
IUPAC Name:2-hydroxy-2-oxoacetate; piperidin-1-yl-[1-(pyridin-4-ylmethyl)piperidin-1-ium-3-yl]methanone
Traditional Name:piperidino-[1-(4-pyridylmethyl)piperidin-1-ium-3-yl]methanone binoxalate
Formula: C19H27N3O5
MolecularWeight: 377.43478
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCC[NH+](C2)CC3=CC=NC=C3.C(=O)(C(=O)[O-])O


Isomeric SMILES

C1CCN(CC1)C(=O)C2CCC[NH+](C2)CC3=CC=NC=C3.C(=O)(C(=O)[O-])O


InChI

InChI=1S/C17H25N3O.C2H2O4/c21-17(20-11-2-1-3-12-20)16-5-4-10-19(14-16)13-15-6-8-18-9-7-15;3-1(4)2(5)6/h6-9,16H,1-5,10-14H2;(H,3,4)(H,5,6)


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