2,2-dimethyl-3-(phenylsulfonyl)propanoic acid

Systemtic Name: 2,2-dimethyl-3-(phenylsulfonyl)propanoic acid Openeye Name: 3-(benzenesulfonyl)-2,2-dimethyl-propanoic acid CAS Name: 3-(benzenesulfonyl)-2,2-dimethylpropanoic acid IUPAC Name: 3-(benzenesulfonyl)-2,2-dimethylpropanoic acid Traditional Name: 3-besyl-2,2-dimethyl-propionic acid Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O4S/c1-11(2,10(12)13)8-16(14,15)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,12,13)