4-(hydroxymethyl)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-benzoic acid

Systemtic Name: 4-(hydroxymethyl)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-benzoic acid Openeye Name: 4-(hydroxymethyl)-3-(2-hydroxy-1-methyl-2-oxo-ethoxy)benzoic acid CAS Name: 4-(hydroxymethyl)-3-(1-hydroxy-1-oxopropan-2-yl)oxybenzoic acid IUPAC Name: 4-(hydroxymethyl)-3-(1-hydroxy-1-oxopropan-2-yl)oxybenzoic acid Traditional Name: 3-(2-hydroxy-2-keto-1-methyl-ethoxy)-4-methylol-benzoic acid Formula: C11H12O6 MolecularWeight: 240.20938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=CC(=C1)C(=O)O)CO

Isomeric SMILES

CC(C(=O)O)OC1=C(C=CC(=C1)C(=O)O)CO

InChI

InChI=1S/C11H12O6/c1-6(10(13)14)17-9-4-7(11(15)16)2-3-8(9)5-12/h2-4,6,12H,5H2,1H3,(H,13,14)(H,15,16)