N-(3-azanylisoquinolin-5-yl)-2,2,2-tris(chloranyl)ethanamide

Systemtic Name: N-(3-azanylisoquinolin-5-yl)-2,2,2-tris(chloranyl)ethanamide Openeye Name: N-(3-amino-5-isoquinolyl)-2,2,2-trichloro-acetamide CAS Name: N-(3-amino-5-isoquinolinyl)-2,2,2-trichloroacetamide IUPAC Name: N-(3-aminoisoquinolin-5-yl)-2,2,2-trichloroacetamide Traditional Name: N-(3-amino-5-isoquinolyl)-2,2,2-trichloro-acetamide Formula: C11H8Cl3N3O MolecularWeight: 304.55972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CN=C(C=C2C(=C1)NC(=O)C(Cl)(Cl)Cl)N

Isomeric SMILES

C1=CC2=CN=C(C=C2C(=C1)NC(=O)C(Cl)(Cl)Cl)N

InChI

InChI=1S/C11H8Cl3N3O/c12-11(13,14)10(18)17-8-3-1-2-6-5-16-9(15)4-7(6)8/h1-5H,(H2,15,16)(H,17,18)