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1-[4-(2-methoxyphenoxy)but-2-ynyl]azepan-1-ium

1-[4-(2-methoxyphenoxy)but-2-ynyl]azepan-1-ium

Systemtic Name:1-[4-(2-methoxyphenoxy)but-2-ynyl]azepan-1-ium
Openeye Name:1-[4-(2-methoxyphenoxy)but-2-ynyl]azepan-1-ium
CAS Name:1-[4-(2-methoxyphenoxy)but-2-ynyl]azepan-1-ium
IUPAC Name:1-[4-(2-methoxyphenoxy)but-2-ynyl]azepan-1-ium
Traditional Name:1-[4-(2-methoxyphenoxy)but-2-ynyl]azepan-1-ium
Formula: C17H24NO2+
MolecularWeight: 274.37796
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC#CC[NH+]2CCCCCC2


Isomeric SMILES

COC1=CC=CC=C1OCC#CC[NH+]2CCCCCC2


InChI

InChI=1S/C17H23NO2/c1-19-16-10-4-5-11-17(16)20-15-9-8-14-18-12-6-2-3-7-13-18/h4-5,10-11H,2-3,6-7,12-15H2,1H3/p+1


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