(4Z)-4-[azanyl(ethylsulfanyl)methylidene]-2-oxidanyl-cyclohexa-2,5-dien-1-one; sulfuric acid

Systemtic Name: (4Z)-4-[azanyl(ethylsulfanyl)methylidene]-2-oxidanyl-cyclohexa-2,5-dien-1-one; sulfuric acid Openeye Name: (4Z)-4-[amino(ethylsulfanyl)methylene]-2-hydroxy-cyclohexa-2,5-dien-1-one; sulfuric acid CAS Name: (4Z)-4-[amino-(ethylthio)methylidene]-2-hydroxy-1-cyclohexa-2,5-dienone; sulfuric acid IUPAC Name: (4Z)-4-[amino(ethylsulfanyl)methylidene]-2-hydroxycyclohexa-2,5-dien-1-one; sulfuric acid Traditional Name: (4Z)-4-[amino-(ethylthio)methylene]-2-hydroxy-cyclohexa-2,5-dien-1-one; sulfuric acid Formula: C9H13NO6S2 MolecularWeight: 295.33262

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C1C=CC(=O)C(=C1)O)N.OS(=O)(=O)O

Isomeric SMILES

CCS/C(=C\1/C=CC(=O)C(=C1)O)/N.OS(=O)(=O)O

InChI

InChI=1S/C9H11NO2S.H2O4S/c1-2-13-9(10)6-3-4-7(11)8(12)5-6;1-5(2,3)4/h3-5,12H,2,10H2,1H3;(H2,1,2,3,4)/b9-6-;