4-nitro-N-[(1S)-4-oxidanylidenecyclopent-2-en-1-yl]-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 4-nitro-N-[(1S)-4-oxidanylidenecyclopent-2-en-1-yl]-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 4-nitro-N-[(1S)-4-oxocyclopent-2-en-1-yl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 4-nitro-N-[(1S)-4-oxo-1-cyclopent-2-enyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 4-nitro-N-[(1S)-4-oxocyclopent-2-en-1-yl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: N-[(1S)-4-ketocyclopent-2-en-1-yl]-4-nitro-N-propargyl-benzenesulfonamide Formula: C14H12N2O5S MolecularWeight: 320.32048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1CC(=O)C=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C#CCN([C@H]1CC(=O)C=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O5S/c1-2-9-15(12-3-6-13(17)10-12)22(20,21)14-7-4-11(5-8-14)16(18)19/h1,3-8,12H,9-10H2/t12-/m1/s1