1-(2-methylpropyl)-4-[1-(2-phenylmethoxyethyl)pyridin-1-ium-4-yl]pyridin-1-ium

Systemtic Name: 1-(2-methylpropyl)-4-[1-(2-phenylmethoxyethyl)pyridin-1-ium-4-yl]pyridin-1-ium Openeye Name: 1-(2-benzyloxyethyl)-4-(1-isobutylpyridin-1-ium-4-yl)pyridin-1-ium CAS Name: 1-(2-methylpropyl)-4-[1-(2-phenylmethoxyethyl)-4-pyridin-1-iumyl]pyridin-1-ium IUPAC Name: 1-(2-methylpropyl)-4-[1-(2-phenylmethoxyethyl)pyridin-1-ium-4-yl]pyridin-1-ium Traditional Name: 1-(2-benzoxyethyl)-4-(1-isobutylpyridin-1-ium-4-yl)pyridin-1-ium Formula: C23H28N2O+2 MolecularWeight: 348.48122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CCOCC3=CC=CC=C3

Isomeric SMILES

CC(C)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CCOCC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O/c1-20(2)18-25-14-10-23(11-15-25)22-8-12-24(13-9-22)16-17-26-19-21-6-4-3-5-7-21/h3-15,20H,16-19H2,1-2H3/q+2