4-nitro-5-oxidanyl-benzo[g][1,3]benzoxathiol-2-one

Systemtic Name: 4-nitro-5-oxidanyl-benzo[g][1,3]benzoxathiol-2-one Openeye Name: 5-hydroxy-4-nitro-benzo[g][1,3]benzoxathiol-2-one CAS Name: 5-hydroxy-4-nitro-2-benzo[g][1,3]benzoxathiolone IUPAC Name: 5-hydroxy-4-nitrobenzo[g][1,3]benzoxathiol-2-one Traditional Name: 5-hydroxy-4-nitro-benzo[g][1,3]benzoxathiol-2-one Formula: C11H5NO5S MolecularWeight: 263.2261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C3=C2OC(=O)S3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C3=C2OC(=O)S3)[N+](=O)[O-])O

InChI

InChI=1S/C11H5NO5S/c13-8-5-3-1-2-4-6(5)9-10(7(8)12(15)16)18-11(14)17-9/h1-4,13H