N-oxidanyl-N-[1-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylnon-3-yn-2-yl]methanamide

Systemtic Name: N-oxidanyl-N-[1-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylnon-3-yn-2-yl]methanamide Openeye Name: N-hydroxy-N-[1-[[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylmethyl]oct-2-ynyl]formamide CAS Name: N-hydroxy-N-[1-[[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]non-3-yn-2-yl]formamide IUPAC Name: N-hydroxy-N-[1-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylnon-3-yn-2-yl]formamide Traditional Name: N-hydroxy-N-[1-[[4-[4-(trifluoromethyl)phenyl]piperazino]sulfonylmethyl]oct-2-ynyl]formamide Formula: C21H28F3N3O4S MolecularWeight: 475.52493

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC(CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C(F)(F)F)N(C=O)O

Isomeric SMILES

CCCCCC#CC(CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C(F)(F)F)N(C=O)O

InChI

InChI=1S/C21H28F3N3O4S/c1-2-3-4-5-6-7-20(27(29)17-28)16-32(30,31)26-14-12-25(13-15-26)19-10-8-18(9-11-19)21(22,23)24/h8-11,17,20,29H,2-5,12-16H2,1H3