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

Systemtic Name: N-[1-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonylnon-3-yn-2-yl]-N-oxidanyl-methanamide Openeye Name: N-hydroxy-N-[1-[[4-(3-methoxyphenyl)piperazin-1-yl]sulfonylmethyl]oct-2-ynyl]formamide CAS Name: N-hydroxy-N-[1-[[4-(3-methoxyphenyl)-1-piperazinyl]sulfonyl]non-3-yn-2-yl]formamide IUPAC Name: N-hydroxy-N-[1-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonylnon-3-yn-2-yl]formamide Traditional Name: N-hydroxy-N-[1-[[4-(3-methoxyphenyl)piperazino]sulfonylmethyl]oct-2-ynyl]formamide Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N3O5S/c1-3-4-5-6-7-9-20(24(26)18-25)17-30(27,28)23-14-12-22(13-15-23)19-10-8-11-21(16-19)29-2/h8,10-11,16,18,20,26H,3-6,12-15,17H2,1-2H3