3-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]propyl-diethyl-azanium

Systemtic Name: 3-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]propyl-diethyl-azanium Openeye Name: 3-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]propyl-diethyl-ammonium CAS Name: 3-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]propyl-diethylammonium IUPAC Name: 3-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-11-yl)amino]propyl-diethylazanium Traditional Name: 3-[(6-cyano-7,8,9,10-tetrahydro-5H-benzimidazol[1,2-b]isoquinolin-12-ium-11-yl)amino]propyl-diethyl-ammonium Formula: C23H31N5+2 MolecularWeight: 377.52574

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC1=C2CCCCC2=C(C3=[N+]1C4=CC=CC=C4N3)C#N

Isomeric SMILES

CC[NH+](CC)CCCNC1=C2CCCCC2=C(C3=[N+]1C4=CC=CC=C4N3)C#N

InChI

InChI=1S/C23H29N5/c1-3-27(4-2)15-9-14-25-22-18-11-6-5-10-17(18)19(16-24)23-26-20-12-7-8-13-21(20)28(22)23/h7-8,12-13H,3-6,9-11,14-15H2,1-2H3,(H,25,26)/p+2