1-(3-phenylpropyl)-4-pyridin-1-ium-4-yl-pyridin-1-ium

Systemtic Name: 1-(3-phenylpropyl)-4-pyridin-1-ium-4-yl-pyridin-1-ium Openeye Name: 1-(3-phenylpropyl)-4-pyridin-1-ium-4-yl-pyridin-1-ium CAS Name: 1-(3-phenylpropyl)-4-(4-pyridin-1-iumyl)pyridin-1-ium IUPAC Name: 1-(3-phenylpropyl)-4-pyridin-1-ium-4-ylpyridin-1-ium Traditional Name: 1-(3-phenylpropyl)-4-pyridin-1-ium-4-yl-pyridin-1-ium Formula: C19H20N2+2 MolecularWeight: 276.3755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N2/c1-2-5-17(6-3-1)7-4-14-21-15-10-19(11-16-21)18-8-12-20-13-9-18/h1-3,5-6,8-13,15-16H,4,7,14H2/q+1/p+1