2-phenethyl-1-propan-2-yl-pyridin-1-ium iodide

Systemtic Name: 2-phenethyl-1-propan-2-yl-pyridin-1-ium iodide Openeye Name: 1-isopropyl-2-phenethyl-pyridin-1-ium iodide CAS Name: 2-phenethyl-1-propan-2-ylpyridin-1-ium iodide IUPAC Name: 2-phenethyl-1-propan-2-ylpyridin-1-ium iodide Traditional Name: 1-isopropyl-2-phenethyl-pyridin-1-ium iodide Formula: C16H20IN MolecularWeight: 353.24117

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=CC=CC=C1CCC2=CC=CC=C2.[I-]

Isomeric SMILES

CC(C)[N+]1=CC=CC=C1CCC2=CC=CC=C2.[I-]

InChI

InChI=1S/C16H20N.HI/c1-14(2)17-13-7-6-10-16(17)12-11-15-8-4-3-5-9-15;/h3-10,13-14H,11-12H2,1-2H3;1H/q+1;/p-1