1-methoxy-2-methyl-1-oxidanylidene-3-phenyl-propane-2-sulfonic acid

Systemtic Name: 1-methoxy-2-methyl-1-oxidanylidene-3-phenyl-propane-2-sulfonic acid Openeye Name: 1-methoxy-2-methyl-1-oxo-3-phenyl-propane-2-sulfonic acid CAS Name: 1-methoxy-2-methyl-1-oxo-3-phenyl-2-propanesulfonic acid IUPAC Name: 1-methoxy-2-methyl-1-oxo-3-phenylpropane-2-sulfonic acid Traditional Name: 1-keto-1-methoxy-2-methyl-3-phenyl-propane-2-sulfonic acid Formula: C11H14O5S MolecularWeight: 258.29086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O5S/c1-11(10(12)16-2,17(13,14)15)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,13,14,15)