1-[3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide

Systemtic Name: 1-[3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide Openeye Name: 1-[3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide CAS Name: 1-[3-(3,3-diphenylpropyl)-1-pyridin-1-iumyl]ethanamine iodide IUPAC Name: 1-[3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide Traditional Name: 1-[3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethylamine iodide Formula: C22H25IN2 MolecularWeight: 444.35177

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Descriptors Computed from Structure

Canonical SMILES:

CC(N)[N+]1=CC=CC(=C1)CCC(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

CC(N)[N+]1=CC=CC(=C1)CCC(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C22H25N2.HI/c1-18(23)24-16-8-9-19(17-24)14-15-22(20-10-4-2-5-11-20)21-12-6-3-7-13-21;/h2-13,16-18,22H,14-15,23H2,1H3;1H/q+1;/p-1