1-heptyl-4-pyridin-4-yl-pyridin-1-ium

Systemtic Name: 1-heptyl-4-pyridin-4-yl-pyridin-1-ium Openeye Name: 1-heptyl-4-(4-pyridyl)pyridin-1-ium CAS Name: 1-heptyl-4-pyridin-4-ylpyridin-1-ium IUPAC Name: 1-heptyl-4-pyridin-4-ylpyridin-1-ium Traditional Name: 1-heptyl-4-(4-pyridyl)pyridin-1-ium Formula: C17H23N2+ MolecularWeight: 255.37792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N2/c1-2-3-4-5-6-13-19-14-9-17(10-15-19)16-7-11-18-12-8-16/h7-12,14-15H,2-6,13H2,1H3/q+1