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6-methyl-2-oxidanyl-3-(1-phenylsulfanyldecyl)pyran-4-one

6-methyl-2-oxidanyl-3-(1-phenylsulfanyldecyl)pyran-4-one

Systemtic Name:6-methyl-2-oxidanyl-3-(1-phenylsulfanyldecyl)pyran-4-one
Openeye Name:2-hydroxy-6-methyl-3-(1-phenylsulfanyldecyl)pyran-4-one
CAS Name:2-hydroxy-6-methyl-3-[1-(phenylthio)decyl]-4-pyranone
IUPAC Name:2-hydroxy-6-methyl-3-(1-phenylsulfanyldecyl)pyran-4-one
Traditional Name:2-hydroxy-6-methyl-3-[1-(phenylthio)decyl]pyran-4-one
Formula: C22H30O3S
MolecularWeight: 374.5368
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C1=C(OC(=CC1=O)C)O)SC2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCC(C1=C(OC(=CC1=O)C)O)SC2=CC=CC=C2


InChI

InChI=1S/C22H30O3S/c1-3-4-5-6-7-8-12-15-20(26-18-13-10-9-11-14-18)21-19(23)16-17(2)25-22(21)24/h9-11,13-14,16,20,24H,3-8,12,15H2,1-2H3


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