6-(1,3-benzodioxol-5-yl)-2-oxidanyl-3-(phenylmethylsulfanyl)pyran-4-one

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-2-oxidanyl-3-(phenylmethylsulfanyl)pyran-4-one Openeye Name: 6-(1,3-benzodioxol-5-yl)-3-benzylsulfanyl-2-hydroxy-pyran-4-one CAS Name: 6-(1,3-benzodioxol-5-yl)-2-hydroxy-3-(phenylmethylthio)-4-pyranone IUPAC Name: 6-(1,3-benzodioxol-5-yl)-3-benzylsulfanyl-2-hydroxypyran-4-one Traditional Name: 6-(1,3-benzodioxol-5-yl)-3-(benzylthio)-2-hydroxy-pyran-4-one Formula: C19H14O5S MolecularWeight: 354.37646

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=O)C(=C(O3)O)SCC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=O)C(=C(O3)O)SCC4=CC=CC=C4

InChI

InChI=1S/C19H14O5S/c20-14-9-16(13-6-7-15-17(8-13)23-11-22-15)24-19(21)18(14)25-10-12-4-2-1-3-5-12/h1-9,21H,10-11H2