3-[(E)-hydroxyiminomethoxy]benzenesulfonic acid; 2,2,2-tris(fluoranyl)-1-(4-methoxyphenyl)ethanone

Systemtic Name: 3-[(E)-hydroxyiminomethoxy]benzenesulfonic acid; 2,2,2-tris(fluoranyl)-1-(4-methoxyphenyl)ethanone Openeye Name: 3-[(E)-hydroxyiminomethoxy]benzenesulfonic acid; 2,2,2-trifluoro-1-(4-methoxyphenyl)ethanone CAS Name: 3-[(E)-hydroxyiminomethoxy]benzenesulfonic acid; 2,2,2-trifluoro-1-(4-methoxyphenyl)ethanone IUPAC Name: 3-[(E)-hydroxyiminomethoxy]benzenesulfonic acid; 2,2,2-trifluoro-1-(4-methoxyphenyl)ethanone Traditional Name: 3-[(E)-hydroximinomethoxy]besylic acid; 2,2,2-trifluoro-1-(4-methoxyphenyl)ethanone Formula: C16H14F3NO7S MolecularWeight: 421.34507

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(F)(F)F.C1=CC(=CC(=C1)S(=O)(=O)O)OC=NO

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C(F)(F)F.C1=CC(=CC(=C1)S(=O)(=O)O)O/C=N/O

InChI

InChI=1S/C9H7F3O2.C7H7NO5S/c1-14-7-4-2-6(3-5-7)8(13)9(10,11)12;9-8-5-13-6-2-1-3-7(4-6)14(10,11)12/h2-5H,1H3;1-5,9H,(H,10,11,12)/b;8-5+