2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-2-ium-3-yl)amino]ethylazanium

Systemtic Name: 2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-2-ium-3-yl)amino]ethylazanium Openeye Name: 2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-2-ium-3-yl)amino]ethylammonium CAS Name: 2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-2-ium-3-yl)amino]ethylammonium IUPAC Name: 2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-2-ium-3-yl)amino]ethylazanium Traditional Name: 2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-2-ium-3-yl)amino]ethylammonium Formula: C13H20N4+2 MolecularWeight: 232.3247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCCC2=C(C(=[NH+]1)NCC[NH3+])C#N

Isomeric SMILES

CC1=C2CCCCC2=C(C(=[NH+]1)NCC[NH3+])C#N

InChI

InChI=1S/C13H18N4/c1-9-10-4-2-3-5-11(10)12(8-15)13(17-9)16-7-6-14/h2-7,14H2,1H3,(H,16,17)/p+2