1-methyl-N-[2-(2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethyl]piperidin-1-ium-1-amine iodide

Systemtic Name: 1-methyl-N-[2-(2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethyl]piperidin-1-ium-1-amine iodide Openeye Name: 1-methyl-N-[2-(2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethyl]piperidin-1-ium-1-amine iodide CAS Name: 1-methyl-N-[2-(2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethyl]-1-piperidin-1-iumamine iodide IUPAC Name: 1-methyl-N-[2-(2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethyl]piperidin-1-ium-1-amine iodide Traditional Name: 2-(2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl)ethyl-(1-methylpiperidin-1-ium-1-yl)amine iodide Formula: C18H31IN3+ MolecularWeight: 416.36331

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)NCC[N+]2(CCC3=CC=CC=C3C2)C.[I-]

Isomeric SMILES

C[N+]1(CCCCC1)NCC[N+]2(CCC3=CC=CC=C3C2)C.[I-]

InChI

InChI=1S/C18H31N3.HI/c1-20(14-10-17-8-4-5-9-18(17)16-20)15-11-19-21(2)12-6-3-7-13-21;/h4-5,8-9,19H,3,6-7,10-16H2,1-2H3;1H/q+2;/p-1