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

Systemtic Name: 11-piperidin-1-yl-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile Openeye Name: 11-(1-piperidyl)-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile CAS Name: 11-(1-piperidinyl)-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile IUPAC Name: 11-piperidin-1-yl-7,8,9,10-tetrahydro-5H-benzimidazolo[1,2-b]isoquinolin-12-ium-6-carbonitrile Traditional Name: 11-piperidino-7,8,9,10-tetrahydro-5H-benzimidazol[1,2-b]isoquinolin-12-ium-6-carbonitrile Formula: C21H23N4+ MolecularWeight: 331.43412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3CCCCC3=C(C4=[N+]2C5=CC=CC=C5N4)C#N

Isomeric SMILES

C1CCN(CC1)C2=C3CCCCC3=C(C4=[N+]2C5=CC=CC=C5N4)C#N

InChI

InChI=1S/C21H22N4/c22-14-17-15-8-2-3-9-16(15)21(24-12-6-1-7-13-24)25-19-11-5-4-10-18(19)23-20(17)25/h4-5,10-11H,1-3,6-9,12-13H2/p+1