5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole-2-thiolate

Systemtic Name: 5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole-2-thiolate Openeye Name: 5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole-2-thiolate CAS Name: 5-(4-methoxy-3-nitrophenyl)-1,3,4-oxadiazole-2-thiolate IUPAC Name: 5-(4-methoxy-3-nitrophenyl)-1,3,4-oxadiazole-2-thiolate Traditional Name: 5-(4-methoxy-3-nitro-phenyl)-1,3,4-oxadiazole-2-thiolate Formula: C9H6N3O4S- MolecularWeight: 252.22664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)[S-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)[S-])[N+](=O)[O-]

InChI

InChI=1S/C9H7N3O4S/c1-15-7-3-2-5(4-6(7)12(13)14)8-10-11-9(17)16-8/h2-4H,1H3,(H,11,17)/p-1