7-[S-methyl-N-(phenylcarbonyl)sulfonimidoyl]-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-[S-methyl-N-(phenylcarbonyl)sulfonimidoyl]-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-(N-benzoyl-S-methyl-sulfonimidoyl)-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-(N-benzoyl-S-methylsulfonimidoyl)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-(N-benzoyl-S-methylsulfonimidoyl)-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-(N-benzoyl-S-methyl-sulfonimidoyl)-9-keto-xanthene-2-carboxylic acid Formula: C22H15NO6S MolecularWeight: 421.4226

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Descriptors Computed from Structure

Canonical SMILES:

CS(=NC(=O)C1=CC=CC=C1)(=O)C2=CC3=C(C=C2)OC4=C(C3=O)C=C(C=C4)C(=O)O

Isomeric SMILES

CS(=NC(=O)C1=CC=CC=C1)(=O)C2=CC3=C(C=C2)OC4=C(C3=O)C=C(C=C4)C(=O)O

InChI

InChI=1S/C22H15NO6S/c1-30(28,23-21(25)13-5-3-2-4-6-13)15-8-10-19-17(12-15)20(24)16-11-14(22(26)27)7-9-18(16)29-19/h2-12H,1H3,(H,26,27)