5-[5-(3,4-dimethoxyphenyl)sulfanylpentoxy]-2-(oxan-2-yloxymethyl)pyran-4-one

Systemtic Name: 5-[5-(3,4-dimethoxyphenyl)sulfanylpentoxy]-2-(oxan-2-yloxymethyl)pyran-4-one Openeye Name: 5-[5-(3,4-dimethoxyphenyl)sulfanylpentoxy]-2-(tetrahydropyran-2-yloxymethyl)pyran-4-one CAS Name: 5-[5-[(3,4-dimethoxyphenyl)thio]pentoxy]-2-(2-oxanyloxymethyl)-4-pyranone IUPAC Name: 5-[5-(3,4-dimethoxyphenyl)sulfanylpentoxy]-2-(oxan-2-yloxymethyl)pyran-4-one Traditional Name: 5-[5-[(3,4-dimethoxyphenyl)thio]pentoxy]-2-(tetrahydropyran-2-yloxymethyl)pyran-4-one Formula: C24H32O7S MolecularWeight: 464.57168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCCCCCOC2=COC(=CC2=O)COC3CCCCO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCCCCCOC2=COC(=CC2=O)COC3CCCCO3)OC

InChI

InChI=1S/C24H32O7S/c1-26-21-10-9-19(15-22(21)27-2)32-13-7-3-5-11-28-23-17-30-18(14-20(23)25)16-31-24-8-4-6-12-29-24/h9-10,14-15,17,24H,3-8,11-13,16H2,1-2H3