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dibutyl-(3-phenylprop-2-ynyl)-prop-2-ynyl-azanium bromide

dibutyl-(3-phenylprop-2-ynyl)-prop-2-ynyl-azanium bromide

Systemtic Name:dibutyl-(3-phenylprop-2-ynyl)-prop-2-ynyl-azanium bromide
Openeye Name:dibutyl-(3-phenylprop-2-ynyl)-prop-2-ynyl-ammonium bromide
CAS Name:dibutyl-(3-phenylprop-2-ynyl)-prop-2-ynylammonium bromide
IUPAC Name:dibutyl-(3-phenylprop-2-ynyl)-prop-2-ynylazanium bromide
Traditional Name:dibutyl-(3-phenylprop-2-ynyl)-propargyl-ammonium bromide
Formula: C20H28BrN
MolecularWeight: 362.34702
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CC#C)CC#CC1=CC=CC=C1.[Br-]


Isomeric SMILES

CCCC[N+](CCCC)(CC#C)CC#CC1=CC=CC=C1.[Br-]


InChI

InChI=1S/C20H28N.BrH/c1-4-7-17-21(16-6-3,18-8-5-2)19-12-15-20-13-10-9-11-14-20;/h3,9-11,13-14H,4-5,7-8,16-19H2,1-2H3;1H/q+1;/p-1


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