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1-[2-(3-propan-2-ylphenoxy)ethyl]azepan-1-ium

1-[2-(3-propan-2-ylphenoxy)ethyl]azepan-1-ium

Systemtic Name:1-[2-(3-propan-2-ylphenoxy)ethyl]azepan-1-ium
Openeye Name:1-[2-(3-isopropylphenoxy)ethyl]azepan-1-ium
CAS Name:1-[2-(3-propan-2-ylphenoxy)ethyl]azepan-1-ium
IUPAC Name:1-[2-(3-propan-2-ylphenoxy)ethyl]azepan-1-ium
Traditional Name:1-[2-(3-isopropylphenoxy)ethyl]azepan-1-ium
Formula: C17H28NO+
MolecularWeight: 262.41032
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OCC[NH+]2CCCCCC2


Isomeric SMILES

CC(C)C1=CC(=CC=C1)OCC[NH+]2CCCCCC2


InChI

InChI=1S/C17H27NO/c1-15(2)16-8-7-9-17(14-16)19-13-12-18-10-5-3-4-6-11-18/h7-9,14-15H,3-6,10-13H2,1-2H3/p+1


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