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2-nitro-5-sulfanylidene-cyclohexa-1,3-diene-1-carboxylic acid

2-nitro-5-sulfanylidene-cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name:2-nitro-5-sulfanylidene-cyclohexa-1,3-diene-1-carboxylic acid
Openeye Name:2-nitro-5-thioxo-cyclohexa-1,3-diene-1-carboxylic acid
CAS Name:2-nitro-5-sulfanylidene-1-cyclohexa-1,3-dienecarboxylic acid
IUPAC Name:2-nitro-5-sulfanylidenecyclohexa-1,3-diene-1-carboxylic acid
Traditional Name:2-nitro-5-thioxo-cyclohexa-1,3-diene-1-carboxylic acid
Formula: C7H5NO4S
MolecularWeight: 199.1839
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C7H5NO4S/c9-7(10)5-3-4(13)1-2-6(5)8(11)12/h1-2H,3H2,(H,9,10)


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