N-[4-[2-(2-methylsulfanylphenyl)-6-phenyl-1,3-dioxan-4-yl]phenyl]-N'-oxidanyl-octanediamide

Systemtic Name: N-[4-[2-(2-methylsulfanylphenyl)-6-phenyl-1,3-dioxan-4-yl]phenyl]-N'-oxidanyl-octanediamide Openeye Name: 8-(hydroxyamino)-N-[4-[2-(2-methylsulfanylphenyl)-6-phenyl-1,3-dioxan-4-yl]phenyl]-8-oxo-octanamide CAS Name: N'-hydroxy-N-[4-[2-[2-(methylthio)phenyl]-6-phenyl-1,3-dioxan-4-yl]phenyl]octanediamide IUPAC Name: N'-hydroxy-N-[4-[2-(2-methylsulfanylphenyl)-6-phenyl-1,3-dioxan-4-yl]phenyl]octanediamide Traditional Name: 8-(hydroxyamino)-8-keto-N-[4-[2-[2-(methylthio)phenyl]-6-phenyl-1,3-dioxan-4-yl]phenyl]caprylamide Formula: C31H36N2O5S MolecularWeight: 548.69294

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C2OC(CC(O2)C3=CC=C(C=C3)NC(=O)CCCCCCC(=O)NO)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1C2OC(CC(O2)C3=CC=C(C=C3)NC(=O)CCCCCCC(=O)NO)C4=CC=CC=C4

InChI

InChI=1S/C31H36N2O5S/c1-39-28-14-10-9-13-25(28)31-37-26(22-11-5-4-6-12-22)21-27(38-31)23-17-19-24(20-18-23)32-29(34)15-7-2-3-8-16-30(35)33-36/h4-6,9-14,17-20,26-27,31,36H,2-3,7-8,15-16,21H2,1H3,(H,32,34)(H,33,35)