3-(4-oxidanyl-4-oxidanylidene-butan-2-yl)benzoic acid

Systemtic Name: 3-(4-oxidanyl-4-oxidanylidene-butan-2-yl)benzoic acid Openeye Name: 3-(3-hydroxy-1-methyl-3-oxo-propyl)benzoic acid CAS Name: 3-(4-hydroxy-4-oxobutan-2-yl)benzoic acid IUPAC Name: 3-(4-hydroxy-4-oxobutan-2-yl)benzoic acid Traditional Name: 3-(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=CC(=C1)C(=O)O

Isomeric SMILES

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

InChI

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