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1,3-benzodioxol-5-ylmethyl-[(3-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium

1,3-benzodioxol-5-ylmethyl-[(3-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name:1,3-benzodioxol-5-ylmethyl-[(3-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium
Openeye Name:1,3-benzodioxol-5-ylmethyl-[(3-fluorophenyl)methyl]-(4-pyridylmethyl)ammonium
CAS Name:1,3-benzodioxol-5-ylmethyl-[(3-fluorophenyl)methyl]-(pyridin-4-ylmethyl)ammonium
IUPAC Name:1,3-benzodioxol-5-ylmethyl-[(3-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium
Traditional Name:(3-fluorobenzyl)-piperonyl-(4-pyridylmethyl)ammonium
Formula: C21H20FN2O2+
MolecularWeight: 351.394103
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH+](CC3=CC=NC=C3)CC4=CC(=CC=C4)F


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH+](CC3=CC=NC=C3)CC4=CC(=CC=C4)F


InChI

InChI=1S/C21H19FN2O2/c22-19-3-1-2-17(10-19)13-24(12-16-6-8-23-9-7-16)14-18-4-5-20-21(11-18)26-15-25-20/h1-11H,12-15H2/p+1


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