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

Systemtic Name: 11-phenylazanyl-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile Openeye Name: 11-anilino-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile CAS Name: 11-anilino-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile IUPAC Name: 11-anilino-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile Traditional Name: 11-anilino-7,8,9,10-tetrahydro-5H-benzimidazol[1,2-b]isoquinolin-12-ium-6-carbonitrile Formula: C22H19N4+ MolecularWeight: 339.41306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C([N+]3=C(C(=C2C1)C#N)NC4=CC=CC=C43)NC5=CC=CC=C5

Isomeric SMILES

C1CCC2=C([N+]3=C(C(=C2C1)C#N)NC4=CC=CC=C43)NC5=CC=CC=C5

InChI

InChI=1S/C22H18N4/c23-14-18-16-10-4-5-11-17(16)21(24-15-8-2-1-3-9-15)26-20-13-7-6-12-19(20)25-22(18)26/h1-3,6-9,12-13H,4-5,10-11H2,(H,24,25)/p+1