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1,3-benzodioxol-5-ylmethyl-[[4-(trifluoromethyl)phenyl]methyl]azanium

1,3-benzodioxol-5-ylmethyl-[[4-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name:1,3-benzodioxol-5-ylmethyl-[[4-(trifluoromethyl)phenyl]methyl]azanium
Openeye Name:1,3-benzodioxol-5-ylmethyl-[[4-(trifluoromethyl)phenyl]methyl]ammonium
CAS Name:1,3-benzodioxol-5-ylmethyl-[[4-(trifluoromethyl)phenyl]methyl]ammonium
IUPAC Name:1,3-benzodioxol-5-ylmethyl-[[4-(trifluoromethyl)phenyl]methyl]azanium
Traditional Name:piperonyl-[4-(trifluoromethyl)benzyl]ammonium
Formula: C16H15F3NO2+
MolecularWeight: 310.29101
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC=C(C=C3)C(F)(F)F


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC=C(C=C3)C(F)(F)F


InChI

InChI=1S/C16H14F3NO2/c17-16(18,19)13-4-1-11(2-5-13)8-20-9-12-3-6-14-15(7-12)22-10-21-14/h1-7,20H,8-10H2/p+1


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