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(7-bromanyl-1,3-benzodioxol-5-yl)methyl-[[3-(trifluoromethyl)phenyl]methyl]azanium

(7-bromanyl-1,3-benzodioxol-5-yl)methyl-[[3-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name:(7-bromanyl-1,3-benzodioxol-5-yl)methyl-[[3-(trifluoromethyl)phenyl]methyl]azanium
Openeye Name:(7-bromo-1,3-benzodioxol-5-yl)methyl-[[3-(trifluoromethyl)phenyl]methyl]ammonium
CAS Name:(7-bromo-1,3-benzodioxol-5-yl)methyl-[[3-(trifluoromethyl)phenyl]methyl]ammonium
IUPAC Name:(7-bromo-1,3-benzodioxol-5-yl)methyl-[[3-(trifluoromethyl)phenyl]methyl]azanium
Traditional Name:(7-bromo-1,3-benzodioxol-5-yl)methyl-[3-(trifluoromethyl)benzyl]ammonium
Formula: C16H14BrF3NO2+
MolecularWeight: 389.18707
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H13BrF3NO2/c17-13-5-11(6-14-15(13)23-9-22-14)8-21-7-10-2-1-3-12(4-10)16(18,19)20/h1-6,21H,7-9H2/p+1


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