2-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazol[1,2-b]isoquinolin-12-ium-11-yl)amino]ethyl-dimethyl-ammonium Formula: C20H25N5+2 MolecularWeight: 335.446

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C2CCCCC2=C(C3=[N+]1C4=CC=CC=C4N3)C#N

Isomeric SMILES

C[NH+](C)CCNC1=C2CCCCC2=C(C3=[N+]1C4=CC=CC=C4N3)C#N

InChI

InChI=1S/C20H23N5/c1-24(2)12-11-22-19-15-8-4-3-7-14(15)16(13-21)20-23-17-9-5-6-10-18(17)25(19)20/h5-6,9-10H,3-4,7-8,11-12H2,1-2H3,(H,22,23)/p+2