1-(3,4-dihydroisoquinolin-1-yl)-2-ethyl-3,4-dihydroisoquinolin-2-ium iodide

Systemtic Name: 1-(3,4-dihydroisoquinolin-1-yl)-2-ethyl-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 1-(3,4-dihydroisoquinolin-1-yl)-2-ethyl-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 1-(3,4-dihydroisoquinolin-1-yl)-2-ethyl-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 1-(3,4-dihydroisoquinolin-1-yl)-2-ethyl-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 1-(3,4-dihydroisoquinolin-1-yl)-2-ethyl-3,4-dihydroisoquinolin-2-ium iodide Formula: C20H21IN2 MolecularWeight: 416.29861

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C2=CC=CC=C2CC1)C3=NCCC4=CC=CC=C43.[I-]

Isomeric SMILES

CC[N+]1=C(C2=CC=CC=C2CC1)C3=NCCC4=CC=CC=C43.[I-]

InChI

InChI=1S/C20H21N2.HI/c1-2-22-14-12-16-8-4-6-10-18(16)20(22)19-17-9-5-3-7-15(17)11-13-21-19;/h3-10H,2,11-14H2,1H3;1H/q+1;/p-1