2-[1-[4-(methylamino)phenyl]isoquinolin-5-yl]propanenitrile

Systemtic Name: 2-[1-[4-(methylamino)phenyl]isoquinolin-5-yl]propanenitrile Openeye Name: 2-[1-[4-(methylamino)phenyl]-5-isoquinolyl]propanenitrile CAS Name: 2-[1-[4-(methylamino)phenyl]-5-isoquinolinyl]propanenitrile IUPAC Name: 2-[1-[4-(methylamino)phenyl]isoquinolin-5-yl]propanenitrile Traditional Name: 2-[1-[4-(methylamino)phenyl]-5-isoquinolyl]propionitrile Formula: C19H17N3 MolecularWeight: 287.35838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC=CC2=C1C=CN=C2C3=CC=C(C=C3)NC

Isomeric SMILES

CC(C#N)C1=CC=CC2=C1C=CN=C2C3=CC=C(C=C3)NC

InChI

InChI=1S/C19H17N3/c1-13(12-20)16-4-3-5-18-17(16)10-11-22-19(18)14-6-8-15(21-2)9-7-14/h3-11,13,21H,1-2H3