2-[1,5-bis(bromanyl)isoquinolin-3-yl]propanenitrile

Systemtic Name: 2-[1,5-bis(bromanyl)isoquinolin-3-yl]propanenitrile Openeye Name: 2-(1,5-dibromo-3-isoquinolyl)propanenitrile CAS Name: 2-(1,5-dibromo-3-isoquinolinyl)propanenitrile IUPAC Name: 2-(1,5-dibromoisoquinolin-3-yl)propanenitrile Traditional Name: 2-(1,5-dibromo-3-isoquinolyl)propionitrile Formula: C12H8Br2N2 MolecularWeight: 340.01332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=NC(=C2C=CC=C(C2=C1)Br)Br

Isomeric SMILES

CC(C#N)C1=NC(=C2C=CC=C(C2=C1)Br)Br

InChI

InChI=1S/C12H8Br2N2/c1-7(6-15)11-5-9-8(12(14)16-11)3-2-4-10(9)13/h2-5,7H,1H3