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

Systemtic Name: 3-(2-tert-butylphenyl)sulfanyl-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-pyran-4-one Openeye Name: 3-(2-tert-butylphenyl)sulfanyl-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-pyran-4-one CAS Name: 3-[(2-tert-butylphenyl)thio]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-pyranone IUPAC Name: 3-(2-tert-butylphenyl)sulfanyl-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxypyran-4-one Traditional Name: 3-[(2-tert-butylphenyl)thio]-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-pyran-4-one Formula: C23H22O5S MolecularWeight: 410.48278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22O5S/c1-23(2,3)15-6-4-5-7-20(15)29-21-16(24)13-18(28-22(21)25)14-8-9-17-19(12-14)27-11-10-26-17/h4-9,12-13,25H,10-11H2,1-3H3