5-(3-methylsulfonylphenoxy)pentan-2-one

Systemtic Name: 5-(3-methylsulfonylphenoxy)pentan-2-one Openeye Name: 5-(3-methylsulfonylphenoxy)pentan-2-one CAS Name: 5-(3-methylsulfonylphenoxy)-2-pentanone IUPAC Name: 5-(3-methylsulfonylphenoxy)pentan-2-one Traditional Name: 5-(3-mesylphenoxy)pentan-2-one Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCOC1=CC(=CC=C1)S(=O)(=O)C

Isomeric SMILES

CC(=O)CCCOC1=CC(=CC=C1)S(=O)(=O)C

InChI

InChI=1S/C12H16O4S/c1-10(13)5-4-8-16-11-6-3-7-12(9-11)17(2,14)15/h3,6-7,9H,4-5,8H2,1-2H3