4-nitro-6-sulfanylidene-cyclohexa-1,3-diene-1,2-dicarboxylic acid

Systemtic Name: 4-nitro-6-sulfanylidene-cyclohexa-1,3-diene-1,2-dicarboxylic acid Openeye Name: 4-nitro-6-thioxo-cyclohexa-1,3-diene-1,2-dicarboxylic acid CAS Name: 4-nitro-6-sulfanylidenecyclohexa-1,3-diene-1,2-dicarboxylic acid IUPAC Name: 4-nitro-6-sulfanylidenecyclohexa-1,3-diene-1,2-dicarboxylic acid Traditional Name: 4-nitro-6-thioxo-cyclohexa-1,3-diene-1,2-dicarboxylic acid Formula: C8H5NO6S MolecularWeight: 243.1934

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC(=C(C1=S)C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1C(=CC(=C(C1=S)C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H5NO6S/c10-7(11)4-1-3(9(14)15)2-5(16)6(4)8(12)13/h1H,2H2,(H,10,11)(H,12,13)