11-(benzimidazol-1-yl)-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile

Systemtic Name: 11-(benzimidazol-1-yl)-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile Openeye Name: 11-(benzimidazol-1-yl)-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile CAS Name: 11-(1-benzimidazolyl)-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile IUPAC Name: 11-(benzimidazol-1-yl)-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile Traditional Name: 11-(benzimidazol-1-yl)-7,8,9,10-tetrahydro-5H-benzimidazol[1,2-b]isoquinolin-12-ium-6-carbonitrile Formula: C23H18N5+ MolecularWeight: 364.42252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C([N+]3=C(C(=C2C1)C#N)NC4=CC=CC=C43)N5C=NC6=CC=CC=C65

Isomeric SMILES

C1CCC2=C([N+]3=C(C(=C2C1)C#N)NC4=CC=CC=C43)N5C=NC6=CC=CC=C65

InChI

InChI=1S/C23H17N5/c24-13-17-15-7-1-2-8-16(15)23(27-14-25-18-9-3-5-11-20(18)27)28-21-12-6-4-10-19(21)26-22(17)28/h3-6,9-12,14H,1-2,7-8H2/p+1