3-(5-carboxy-6-nitro-3-sulfanylidene-cyclohexa-1,5-dien-1-yl)-2-nitro-5-sulfanylidene-cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: 3-(5-carboxy-6-nitro-3-sulfanylidene-cyclohexa-1,5-dien-1-yl)-2-nitro-5-sulfanylidene-cyclohexa-1,3-diene-1-carboxylic acid Openeye Name: 3-(5-carboxy-6-nitro-3-thioxo-cyclohexa-1,5-dien-1-yl)-2-nitro-5-thioxo-cyclohexa-1,3-diene-1-carboxylic acid CAS Name: 3-(5-carboxy-6-nitro-3-sulfanylidene-1-cyclohexa-1,5-dienyl)-2-nitro-5-sulfanylidene-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: 3-(5-carboxy-6-nitro-3-sulfanylidenecyclohexa-1,5-dien-1-yl)-2-nitro-5-sulfanylidenecyclohexa-1,3-diene-1-carboxylic acid Traditional Name: 3-(5-carboxy-6-nitro-3-thioxo-cyclohexa-1,5-dien-1-yl)-2-nitro-5-thioxo-cyclohexa-1,3-diene-1-carboxylic acid Formula: C14H8N2O8S2 MolecularWeight: 396.35192

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=S)C=C(C(=C1C(=O)O)[N+](=O)[O-])C2=CC(=S)CC(=C2[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C(=S)C=C(C(=C1C(=O)O)[N+](=O)[O-])C2=CC(=S)CC(=C2[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H8N2O8S2/c17-13(18)9-3-5(25)1-7(11(9)15(21)22)8-2-6(26)4-10(14(19)20)12(8)16(23)24/h1-2H,3-4H2,(H,17,18)(H,19,20)