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ethyl-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]azanium

ethyl-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]azanium

Systemtic Name:ethyl-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]azanium
Openeye Name:ethyl-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]ammonium
CAS Name:ethyl-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]ammonium
IUPAC Name:ethyl-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]azanium
Traditional Name:ethyl-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]ammonium
Formula: C13H15F3NO+
MolecularWeight: 258.25951
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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC#CCOC1=CC=CC(=C1)C(F)(F)F


Isomeric SMILES

CC[NH2+]CC#CCOC1=CC=CC(=C1)C(F)(F)F


InChI

InChI=1S/C13H14F3NO/c1-2-17-8-3-4-9-18-12-7-5-6-11(10-12)13(14,15)16/h5-7,10,17H,2,8-9H2,1H3/p+1


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