2-[(4-methylphenyl)methylsulfonyl]ethanoate

Systemtic Name: 2-[(4-methylphenyl)methylsulfonyl]ethanoate Openeye Name: 2-(p-tolylmethylsulfonyl)acetate CAS Name: 2-[(4-methylphenyl)methylsulfonyl]acetate IUPAC Name: 2-[(4-methylphenyl)methylsulfonyl]acetate Traditional Name: 2-(4-methylbenzyl)sulfonylacetate Formula: C10H11O4S- MolecularWeight: 227.25694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)CC(=O)[O-]

InChI

InChI=1S/C10H12O4S/c1-8-2-4-9(5-3-8)6-15(13,14)7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)/p-1