methyl 2,2-dimethyl-3-(phenylsulfonyl)propanoate

Systemtic Name: methyl 2,2-dimethyl-3-(phenylsulfonyl)propanoate Openeye Name: methyl 3-(benzenesulfonyl)-2,2-dimethyl-propanoate CAS Name: 3-(benzenesulfonyl)-2,2-dimethylpropanoic acid methyl ester IUPAC Name: methyl 3-(benzenesulfonyl)-2,2-dimethylpropanoate Traditional Name: 3-besyl-2,2-dimethyl-propionic acid methyl ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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