6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-3-(2-isopropylphenyl)sulfanyl-pyran-4-one CAS Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-3-(o-cumenylthio)pyran-4-one Formula: C22H20O5S MolecularWeight: 396.4562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC4=C(C=C3)OCCO4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC4=C(C=C3)OCCO4)O

InChI

InChI=1S/C22H20O5S/c1-13(2)15-5-3-4-6-20(15)28-21-16(23)12-18(27-22(21)24)14-7-8-17-19(11-14)26-10-9-25-17/h3-8,11-13,24H,9-10H2,1-2H3