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3-[1,3-benzodioxol-5-ylmethyl-(3-fluorophenyl)amino]propylazanium

3-[1,3-benzodioxol-5-ylmethyl-(3-fluorophenyl)amino]propylazanium

Systemtic Name:3-[1,3-benzodioxol-5-ylmethyl-(3-fluorophenyl)amino]propylazanium
Openeye Name:3-[N-(1,3-benzodioxol-5-ylmethyl)-3-fluoro-anilino]propylammonium
CAS Name:3-[N-(1,3-benzodioxol-5-ylmethyl)-3-fluoroanilino]propylammonium
IUPAC Name:3-[N-(1,3-benzodioxol-5-ylmethyl)-3-fluoroanilino]propylazanium
Traditional Name:3-(3-fluoro-N-piperonyl-anilino)propylammonium
Formula: C17H20FN2O2+
MolecularWeight: 303.351303
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(CCC[NH3+])C3=CC(=CC=C3)F


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(CCC[NH3+])C3=CC(=CC=C3)F


InChI

InChI=1S/C17H19FN2O2/c18-14-3-1-4-15(10-14)20(8-2-7-19)11-13-5-6-16-17(9-13)22-12-21-16/h1,3-6,9-10H,2,7-8,11-12,19H2/p+1


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