5-(3,3-dimethylbutanoyl)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(3,3-dimethylbutanoyl)-2-oxidanyl-benzoic acid Openeye Name: 5-(3,3-dimethylbutanoyl)-2-hydroxy-benzoic acid CAS Name: 5-(3,3-dimethyl-1-oxobutyl)-2-hydroxybenzoic acid IUPAC Name: 5-(3,3-dimethylbutanoyl)-2-hydroxybenzoic acid Traditional Name: 5-(3,3-dimethylbutanoyl)-2-hydroxy-benzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-13(2,3)7-11(15)8-4-5-10(14)9(6-8)12(16)17/h4-6,14H,7H2,1-3H3,(H,16,17)