3-[(4-methylphenyl)sulfonylmethyl]heptan-2-one

Systemtic Name: 3-[(4-methylphenyl)sulfonylmethyl]heptan-2-one Openeye Name: 3-(p-tolylsulfonylmethyl)heptan-2-one CAS Name: 3-[(4-methylphenyl)sulfonylmethyl]-2-heptanone IUPAC Name: 3-[(4-methylphenyl)sulfonylmethyl]heptan-2-one Traditional Name: 3-(tosylmethyl)heptan-2-one Formula: C15H22O3S MolecularWeight: 282.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CS(=O)(=O)C1=CC=C(C=C1)C)C(=O)C

Isomeric SMILES

CCCCC(CS(=O)(=O)C1=CC=C(C=C1)C)C(=O)C

InChI

InChI=1S/C15H22O3S/c1-4-5-6-14(13(3)16)11-19(17,18)15-9-7-12(2)8-10-15/h7-10,14H,4-6,11H2,1-3H3