(3E)-6-oxidanylidene-3-[[4-(trioxidanylsulfanyl)phenyl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: (3E)-6-oxidanylidene-3-[[4-(trioxidanylsulfanyl)phenyl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: (3E)-6-oxo-3-[[4-(trioxidanylsulfanyl)phenyl]hydrazono]cyclohexa-1,4-diene-1-carboxylic acid CAS Name: (3E)-6-oxo-3-[[4-(trioxidanylthio)phenyl]hydrazinylidene]-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: (3E)-6-oxo-3-[[4-(trioxidanylsulfanyl)phenyl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylic acid Traditional Name: (3E)-6-keto-3-[[4-(trioxidanylthio)phenyl]hydrazono]cyclohexa-1,4-diene-1-carboxylic acid Formula: C13H10N2O6S MolecularWeight: 322.2933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C=CC(=O)C(=C2)C(=O)O)SOOO

Isomeric SMILES

C1=CC(=CC=C1N/N=C/2\C=CC(=O)C(=C2)C(=O)O)SOOO

InChI

InChI=1S/C13H10N2O6S/c16-12-6-3-9(7-11(12)13(17)18)15-14-8-1-4-10(5-2-8)22-21-20-19/h1-7,14,19H,(H,17,18)/b15-9+