methyl 2-methyl-3-(4-methylphenyl)sulfonyl-propanoate

Systemtic Name: methyl 2-methyl-3-(4-methylphenyl)sulfonyl-propanoate Openeye Name: methyl 2-methyl-3-(p-tolylsulfonyl)propanoate CAS Name: 2-methyl-3-(4-methylphenyl)sulfonylpropanoic acid methyl ester IUPAC Name: methyl 2-methyl-3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 2-methyl-3-tosyl-propionic acid methyl ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(C)C(=O)OC

InChI

InChI=1S/C12H16O4S/c1-9-4-6-11(7-5-9)17(14,15)8-10(2)12(13)16-3/h4-7,10H,8H2,1-3H3