2-[3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)phenyl]propanoic acid

Systemtic Name: 2-[3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)phenyl]propanoic acid Openeye Name: 2-[3-(2-hydroxy-1-methyl-2-oxo-ethyl)phenyl]propanoic acid CAS Name: 2-[3-(1-hydroxy-1-oxopropan-2-yl)phenyl]propanoic acid IUPAC Name: 2-[3-(1-hydroxy-1-oxopropan-2-yl)phenyl]propanoic acid Traditional Name: 2-[3-(2-hydroxy-2-keto-1-methyl-ethyl)phenyl]propionic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O4/c1-7(11(13)14)9-4-3-5-10(6-9)8(2)12(15)16/h3-8H,1-2H3,(H,13,14)(H,15,16)