1-butyl-4-pyridin-4-yl-pyridin-1-ium

Systemtic Name: 1-butyl-4-pyridin-4-yl-pyridin-1-ium Openeye Name: 1-butyl-4-(4-pyridyl)pyridin-1-ium CAS Name: 1-butyl-4-pyridin-4-ylpyridin-1-ium IUPAC Name: 1-butyl-4-pyridin-4-ylpyridin-1-ium Traditional Name: 1-butyl-4-(4-pyridyl)pyridin-1-ium Formula: C14H17N2+ MolecularWeight: 213.29818

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=C(C=C1)C2=CC=NC=C2

Isomeric SMILES

CCCC[N+]1=CC=C(C=C1)C2=CC=NC=C2

InChI

InChI=1S/C14H17N2/c1-2-3-10-16-11-6-14(7-12-16)13-4-8-15-9-5-13/h4-9,11-12H,2-3,10H2,1H3/q+1