1-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 1-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 1-[1-[(3-fluorophenyl)methyl]-4-piperidyl]-4-(2-methoxyphenyl)piperazin-1-ium; 2-hydroxy-2-oxo-acetate CAS Name: 1-[1-[(3-fluorophenyl)methyl]-4-piperidinyl]-4-(2-methoxyphenyl)piperazin-1-ium; 2-hydroxy-2-oxoacetate IUPAC Name: 1-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-4-(2-methoxyphenyl)piperazin-1-ium; 2-hydroxy-2-oxoacetate Traditional Name: 1-[1-(3-fluorobenzyl)-4-piperidyl]-4-(2-methoxyphenyl)piperazin-1-ium binoxalate Formula: C25H32FN3O5 MolecularWeight: 473.537083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCN(CC3)CC4=CC(=CC=C4)F.C(=O)(C(=O)[O-])O

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCN(CC3)CC4=CC(=CC=C4)F.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C23H30FN3O.C2H2O4/c1-28-23-8-3-2-7-22(23)27-15-13-26(14-16-27)21-9-11-25(12-10-21)18-19-5-4-6-20(24)17-19;3-1(4)2(5)6/h2-8,17,21H,9-16,18H2,1H3;(H,3,4)(H,5,6)