4-(4-isoquinolin-1-ylpiperazin-1-yl)butanenitrile

Systemtic Name: 4-(4-isoquinolin-1-ylpiperazin-1-yl)butanenitrile Openeye Name: 4-[4-(1-isoquinolyl)piperazin-1-yl]butanenitrile CAS Name: 4-[4-(1-isoquinolinyl)-1-piperazinyl]butanenitrile IUPAC Name: 4-(4-isoquinolin-1-ylpiperazin-1-yl)butanenitrile Traditional Name: 4-[4-(1-isoquinolyl)piperazino]butyronitrile Formula: C17H20N4 MolecularWeight: 280.3675

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC#N)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

C1CN(CCN1CCCC#N)C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C17H20N4/c18-8-3-4-10-20-11-13-21(14-12-20)17-16-6-2-1-5-15(16)7-9-19-17/h1-2,5-7,9H,3-4,10-14H2