4-[(2R)-4-oxidanyl-4-oxidanylidene-butan-2-yl]benzoic acid

Systemtic Name: 4-[(2R)-4-oxidanyl-4-oxidanylidene-butan-2-yl]benzoic acid Openeye Name: 4-[(1R)-3-hydroxy-1-methyl-3-oxo-propyl]benzoic acid CAS Name: 4-[(2R)-4-hydroxy-4-oxobutan-2-yl]benzoic acid IUPAC Name: 4-[(2R)-4-hydroxy-4-oxobutan-2-yl]benzoic acid Traditional Name: 4-[(1R)-3-hydroxy-3-keto-1-methyl-propyl]benzoic acid Formula: C11H12O4 MolecularWeight: 208.21058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](CC(=O)O)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C11H12O4/c1-7(6-10(12)13)8-2-4-9(5-3-8)11(14)15/h2-5,7H,6H2,1H3,(H,12,13)(H,14,15)/t7-/m1/s1