1-[4-[3-[4-(3-methyl-2-oxidanyl-butyl)phenyl]sulfonylpropoxy]-2-oxidanyl-3-propyl-phenyl]ethanone

Systemtic Name: 1-[4-[3-[4-(3-methyl-2-oxidanyl-butyl)phenyl]sulfonylpropoxy]-2-oxidanyl-3-propyl-phenyl]ethanone Openeye Name: 1-[2-hydroxy-4-[3-[4-(2-hydroxy-3-methyl-butyl)phenyl]sulfonylpropoxy]-3-propyl-phenyl]ethanone CAS Name: 1-[2-hydroxy-4-[3-[4-(2-hydroxy-3-methylbutyl)phenyl]sulfonylpropoxy]-3-propylphenyl]ethanone IUPAC Name: 1-[2-hydroxy-4-[3-[4-(2-hydroxy-3-methylbutyl)phenyl]sulfonylpropoxy]-3-propylphenyl]ethanone Traditional Name: 1-[2-hydroxy-4-[3-[4-(2-hydroxy-3-methyl-butyl)phenyl]sulfonylpropoxy]-3-propyl-phenyl]ethanone Formula: C25H34O6S MolecularWeight: 462.59886

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCS(=O)(=O)C2=CC=C(C=C2)CC(C(C)C)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCS(=O)(=O)C2=CC=C(C=C2)CC(C(C)C)O

InChI

InChI=1S/C25H34O6S/c1-5-7-22-24(13-12-21(18(4)26)25(22)28)31-14-6-15-32(29,30)20-10-8-19(9-11-20)16-23(27)17(2)3/h8-13,17,23,27-28H,5-7,14-16H2,1-4H3