4-[(3E)-3-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide

Systemtic Name: 4-[(3E)-3-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide Openeye Name: 4-[(3E)-3-(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide CAS Name: 4-[(3E)-3-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide IUPAC Name: 4-[(3E)-3-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide Traditional Name: 4-[(5E)-5-(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-3-(trifluoromethyl)-3-pyrazolin-1-yl]benzenesulfonamide Formula: C16H12F3N3O4S MolecularWeight: 399.34439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=C3C=CC(=O)C(=C3)O)C=C(N2)C(F)(F)F)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1N2/C(=C/3\C=CC(=O)C(=C3)O)/C=C(N2)C(F)(F)F)S(=O)(=O)N

InChI

InChI=1S/C16H12F3N3O4S/c17-16(18,19)15-8-12(9-1-6-13(23)14(24)7-9)22(21-15)10-2-4-11(5-3-10)27(20,25)26/h1-8,21,24H,(H2,20,25,26)/b12-9+