3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene; 4-phenyl-3H-1,3-oxazole-2-thione

Systemtic Name: 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene; 4-phenyl-3H-1,3-oxazole-2-thione Openeye Name: 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene; 4-phenyl-3H-oxazole-2-thione CAS Name: 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene; 4-phenyl-3H-oxazole-2-thione IUPAC Name: 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene; 4-phenyl-3H-1,3-oxazole-2-thione Traditional Name: 3-nitrobicyclo[2.2.0]hexa-1(4),2,5-triene; 4-phenyl-4-oxazoline-2-thione Formula: C15H10N2O3S MolecularWeight: 298.3165

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=COC(=S)N2.C1=CC2=C1C=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=COC(=S)N2.C1=CC2=C1C=C2[N+](=O)[O-]

InChI

InChI=1S/C9H7NOS.C6H3NO2/c12-9-10-8(6-11-9)7-4-2-1-3-5-7;8-7(9)6-3-4-1-2-5(4)6/h1-6H,(H,10,12);1-3H