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4-(2,5-dimethylphenoxy)but-2-ynyl-methyl-azanium

4-(2,5-dimethylphenoxy)but-2-ynyl-methyl-azanium

Systemtic Name:4-(2,5-dimethylphenoxy)but-2-ynyl-methyl-azanium
Openeye Name:4-(2,5-dimethylphenoxy)but-2-ynyl-methyl-ammonium
CAS Name:4-(2,5-dimethylphenoxy)but-2-ynyl-methylammonium
IUPAC Name:4-(2,5-dimethylphenoxy)but-2-ynyl-methylazanium
Traditional Name:4-(2,5-dimethylphenoxy)but-2-ynyl-methyl-ammonium
Formula: C13H18NO+
MolecularWeight: 204.28812
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC#CC[NH2+]C


Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC#CC[NH2+]C


InChI

InChI=1S/C13H17NO/c1-11-6-7-12(2)13(10-11)15-9-5-4-8-14-3/h6-7,10,14H,8-9H2,1-3H3/p+1


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