2-[(8-nitroisoquinolin-5-yl)amino]ethanesulfonamide

Systemtic Name: 2-[(8-nitroisoquinolin-5-yl)amino]ethanesulfonamide Openeye Name: 2-[(8-nitro-5-isoquinolyl)amino]ethanesulfonamide CAS Name: 2-[(8-nitro-5-isoquinolinyl)amino]ethanesulfonamide IUPAC Name: 2-[(8-nitroisoquinolin-5-yl)amino]ethanesulfonamide Traditional Name: 2-[(8-nitro-5-isoquinolyl)amino]ethanesulfonamide Formula: C11H12N4O4S MolecularWeight: 296.30238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=NC=CC2=C1NCCS(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C=NC=CC2=C1NCCS(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O4S/c12-20(18,19)6-5-14-10-1-2-11(15(16)17)9-7-13-4-3-8(9)10/h1-4,7,14H,5-6H2,(H2,12,18,19)