1-phenethyl-4-pyridin-4-yl-pyridin-1-ium

Systemtic Name: 1-phenethyl-4-pyridin-4-yl-pyridin-1-ium Openeye Name: 1-phenethyl-4-(4-pyridyl)pyridin-1-ium CAS Name: 1-phenethyl-4-pyridin-4-ylpyridin-1-ium IUPAC Name: 1-phenethyl-4-pyridin-4-ylpyridin-1-ium Traditional Name: 1-phenethyl-4-(4-pyridyl)pyridin-1-ium Formula: C18H17N2+ MolecularWeight: 261.34098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[N+]2=CC=C(C=C2)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC[N+]2=CC=C(C=C2)C3=CC=NC=C3

InChI

InChI=1S/C18H17N2/c1-2-4-16(5-3-1)8-13-20-14-9-18(10-15-20)17-6-11-19-12-7-17/h1-7,9-12,14-15H,8,13H2/q+1