4-[4-(4-fluoranylphenoxy)phenyl]sulfonyl-N1-methyl-N3-oxidanyl-piperazine-1,3-dicarboxamide

Systemtic Name: 4-[4-(4-fluoranylphenoxy)phenyl]sulfonyl-N1-methyl-N3-oxidanyl-piperazine-1,3-dicarboxamide Openeye Name: 4-[4-(4-fluorophenoxy)phenyl]sulfonyl-3-(hydroxycarbamoyl)-N-methyl-piperazine-1-carboxamide CAS Name: 4-[4-(4-fluorophenoxy)phenyl]sulfonyl-N3-hydroxy-N1-methylpiperazine-1,3-dicarboxamide IUPAC Name: 4-[4-(4-fluorophenoxy)phenyl]sulfonyl-3-N-hydroxy-1-N-methylpiperazine-1,3-dicarboxamide Traditional Name: 4-[4-(4-fluorophenoxy)phenyl]sulfonyl-3-(hydroxycarbamoyl)-N-methyl-piperazine-1-carboxamide Formula: C19H21FN4O6S MolecularWeight: 452.456643

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)F

Isomeric SMILES

CNC(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C19H21FN4O6S/c1-21-19(26)23-10-11-24(17(12-23)18(25)22-27)31(28,29)16-8-6-15(7-9-16)30-14-4-2-13(20)3-5-14/h2-9,17,27H,10-12H2,1H3,(H,21,26)(H,22,25)