6-(3-methoxyphenyl)sulfanyl-4-oxidanyl-heptan-2-one

Systemtic Name: 6-(3-methoxyphenyl)sulfanyl-4-oxidanyl-heptan-2-one Openeye Name: 4-hydroxy-6-(3-methoxyphenyl)sulfanyl-heptan-2-one CAS Name: 4-hydroxy-6-[(3-methoxyphenyl)thio]-2-heptanone IUPAC Name: 4-hydroxy-6-(3-methoxyphenyl)sulfanylheptan-2-one Traditional Name: 4-hydroxy-6-[(3-methoxyphenyl)thio]heptan-2-one Formula: C14H20O3S MolecularWeight: 268.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC(=O)C)O)SC1=CC=CC(=C1)OC

Isomeric SMILES

CC(CC(CC(=O)C)O)SC1=CC=CC(=C1)OC

InChI

InChI=1S/C14H20O3S/c1-10(15)7-12(16)8-11(2)18-14-6-4-5-13(9-14)17-3/h4-6,9,11-12,16H,7-8H2,1-3H3