2-methyl-2-phenethylsulfonyloxy-propanoic acid

Systemtic Name: 2-methyl-2-phenethylsulfonyloxy-propanoic acid Openeye Name: 2-methyl-2-phenethylsulfonyloxy-propanoic acid CAS Name: 2-methyl-2-phenethylsulfonyloxypropanoic acid IUPAC Name: 2-methyl-2-phenethylsulfonyloxypropanoic acid Traditional Name: 2-methyl-2-phenethylsulfonyloxy-propionic acid Formula: C12H16O5S MolecularWeight: 272.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OS(=O)(=O)CCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C(=O)O)OS(=O)(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C12H16O5S/c1-12(2,11(13)14)17-18(15,16)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,13,14)