1-oxidanyl-3-oxidanylidene-3-(4-propan-2-ylphenyl)propane-1-sulfonic acid

Systemtic Name: 1-oxidanyl-3-oxidanylidene-3-(4-propan-2-ylphenyl)propane-1-sulfonic acid Openeye Name: 1-hydroxy-3-(4-isopropylphenyl)-3-oxo-propane-1-sulfonic acid CAS Name: 1-hydroxy-3-oxo-3-(4-propan-2-ylphenyl)-1-propanesulfonic acid IUPAC Name: 1-hydroxy-3-oxo-3-(4-propan-2-ylphenyl)propane-1-sulfonic acid Traditional Name: 1-hydroxy-3-keto-3-p-cumenyl-propane-1-sulfonic acid Formula: C12H16O5S MolecularWeight: 272.31744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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