3-(1-isoquinolin-1-ylpiperidin-4-yl)propanenitrile

Systemtic Name: 3-(1-isoquinolin-1-ylpiperidin-4-yl)propanenitrile Openeye Name: 3-[1-(1-isoquinolyl)-4-piperidyl]propanenitrile CAS Name: 3-[1-(1-isoquinolinyl)-4-piperidinyl]propanenitrile IUPAC Name: 3-(1-isoquinolin-1-ylpiperidin-4-yl)propanenitrile Traditional Name: 3-[1-(1-isoquinolyl)-4-piperidyl]propionitrile Formula: C17H19N3 MolecularWeight: 265.35286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC#N)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

C1CN(CCC1CCC#N)C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C17H19N3/c18-10-3-4-14-8-12-20(13-9-14)17-16-6-2-1-5-15(16)7-11-19-17/h1-2,5-7,11,14H,3-4,8-9,12-13H2