heptan-4-yl(2-pyridin-2-ylethyl)azanium

Systemtic Name: heptan-4-yl(2-pyridin-2-ylethyl)azanium Openeye Name: 1-propylbutyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: heptan-4-yl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: heptan-4-yl(2-pyridin-2-ylethyl)azanium Traditional Name: 1-propylbutyl-[2-(2-pyridyl)ethyl]ammonium Formula: C14H25N2+ MolecularWeight: 221.3617

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)[NH2+]CCC1=CC=CC=N1

Isomeric SMILES

CCCC(CCC)[NH2+]CCC1=CC=CC=N1

InChI

InChI=1S/C14H24N2/c1-3-7-13(8-4-2)16-12-10-14-9-5-6-11-15-14/h5-6,9,11,13,16H,3-4,7-8,10,12H2,1-2H3/p+1