4-nitro-N-(2-oxidanylidenepropyl)benzenesulfonamide

Systemtic Name: 4-nitro-N-(2-oxidanylidenepropyl)benzenesulfonamide Openeye Name: N-acetonyl-4-nitro-benzenesulfonamide CAS Name: 4-nitro-N-(2-oxopropyl)benzenesulfonamide IUPAC Name: 4-nitro-N-(2-oxopropyl)benzenesulfonamide Traditional Name: N-acetonyl-4-nitro-benzenesulfonamide Formula: C9H10N2O5S MolecularWeight: 258.2511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CNS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CNS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O5S/c1-7(12)6-10-17(15,16)9-4-2-8(3-5-9)11(13)14/h2-5,10H,6H2,1H3