2-[4-(3-azanyl-1H-isoquinolin-2-yl)phenyl]propanenitrile hydrobromide

Systemtic Name: 2-[4-(3-azanyl-1H-isoquinolin-2-yl)phenyl]propanenitrile hydrobromide Openeye Name: 2-[4-(3-amino-1H-isoquinolin-2-yl)phenyl]propanenitrile hydrobromide CAS Name: 2-[4-(3-amino-1H-isoquinolin-2-yl)phenyl]propanenitrile hydrobromide IUPAC Name: 2-[4-(3-amino-1H-isoquinolin-2-yl)phenyl]propanenitrile hydrobromide Traditional Name: 2-[4-(3-amino-1H-isoquinolin-2-yl)phenyl]propionitrile hydrobromide Formula: C18H18BrN3 MolecularWeight: 356.25962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC=C(C=C1)N2CC3=CC=CC=C3C=C2N.Br

Isomeric SMILES

CC(C#N)C1=CC=C(C=C1)N2CC3=CC=CC=C3C=C2N.Br

InChI

InChI=1S/C18H17N3.BrH/c1-13(11-19)14-6-8-17(9-7-14)21-12-16-5-3-2-4-15(16)10-18(21)20;/h2-10,13H,12,20H2,1H3;1H