ethyl-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-(phenylmethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: ethyl-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-(phenylmethyl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: benzyl-ethyl-[1-[(3-fluorophenyl)methyl]-4-piperidyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: ethyl-[1-[(3-fluorophenyl)methyl]-4-piperidinyl]-(phenylmethyl)ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: benzyl-ethyl-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: benzyl-ethyl-[1-(3-fluorobenzyl)-4-piperidyl]ammonium binoxalate Formula: C23H29FN2O4 MolecularWeight: 416.485763

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)C2CCN(CC2)CC3=CC(=CC=C3)F.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)C2CCN(CC2)CC3=CC(=CC=C3)F.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C21H27FN2.C2H2O4/c1-2-24(17-18-7-4-3-5-8-18)21-11-13-23(14-12-21)16-19-9-6-10-20(22)15-19;3-1(4)2(5)6/h3-10,15,21H,2,11-14,16-17H2,1H3;(H,3,4)(H,5,6)