3-nitro-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[3-(6-oxidanylidenepyridazin-1-yl)propyl]benzenesulfonamide Openeye Name: 3-nitro-N-[3-(6-oxopyridazin-1-yl)propyl]benzenesulfonamide CAS Name: 3-nitro-N-[3-(6-oxo-1-pyridazinyl)propyl]benzenesulfonamide IUPAC Name: 3-nitro-N-[3-(6-oxopyridazin-1-yl)propyl]benzenesulfonamide Traditional Name: N-[3-(6-ketopyridazin-1-yl)propyl]-3-nitro-benzenesulfonamide Formula: C13H14N4O5S MolecularWeight: 338.33906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C(=O)C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C(=O)C=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O5S/c18-13-6-2-7-14-16(13)9-3-8-15-23(21,22)12-5-1-4-11(10-12)17(19)20/h1-2,4-7,10,15H,3,8-9H2