(2E)-2-[chloranyl(nitro)methylidene]-1,3-thiazepane

Systemtic Name: (2E)-2-[chloranyl(nitro)methylidene]-1,3-thiazepane Openeye Name: (2E)-2-[chloro(nitro)methylene]-1,3-thiazepane CAS Name: (2E)-2-[chloro(nitro)methylidene]-1,3-thiazepane IUPAC Name: (2E)-2-[chloro(nitro)methylidene]-1,3-thiazepane Traditional Name: (2E)-2-[chloro(nitro)methylene]-1,3-thiazepane Formula: C6H9ClN2O2S MolecularWeight: 208.66586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCSC(=C([N+](=O)[O-])Cl)NC1

Isomeric SMILES

C1CCS/C(=C(\[N+](=O)[O-])/Cl)/NC1

InChI

InChI=1S/C6H9ClN2O2S/c7-5(9(10)11)6-8-3-1-2-4-12-6/h8H,1-4H2/b6-5-