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1,3-benzodioxol-5-ylmethyl-[(5-cyano-2-fluoranyl-phenyl)methyl]-cyclopentyl-azanium

1,3-benzodioxol-5-ylmethyl-[(5-cyano-2-fluoranyl-phenyl)methyl]-cyclopentyl-azanium

Systemtic Name:1,3-benzodioxol-5-ylmethyl-[(5-cyano-2-fluoranyl-phenyl)methyl]-cyclopentyl-azanium
Openeye Name:1,3-benzodioxol-5-ylmethyl-[(5-cyano-2-fluoro-phenyl)methyl]-cyclopentyl-ammonium
CAS Name:1,3-benzodioxol-5-ylmethyl-[(5-cyano-2-fluorophenyl)methyl]-cyclopentylammonium
IUPAC Name:1,3-benzodioxol-5-ylmethyl-[(5-cyano-2-fluorophenyl)methyl]-cyclopentylazanium
Traditional Name:(5-cyano-2-fluoro-benzyl)-cyclopentyl-piperonyl-ammonium
Formula: C21H22FN2O2+
MolecularWeight: 353.409983
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+](CC2=CC3=C(C=C2)OCO3)CC4=C(C=CC(=C4)C#N)F


Isomeric SMILES

C1CCC(C1)[NH+](CC2=CC3=C(C=C2)OCO3)CC4=C(C=CC(=C4)C#N)F


InChI

InChI=1S/C21H21FN2O2/c22-19-7-5-15(11-23)9-17(19)13-24(18-3-1-2-4-18)12-16-6-8-20-21(10-16)26-14-25-20/h5-10,18H,1-4,12-14H2/p+1


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