1-[4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide

Systemtic Name: 1-[4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide Openeye Name: 1-[4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide CAS Name: 1-[4-(3,3-diphenylpropyl)-1-pyridin-1-iumyl]ethanamine iodide IUPAC Name: 1-[4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]ethanamine iodide Traditional Name: 1-[4-(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=C(C=C1)CCC(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

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

InChI

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