4-(3-bromanyl-4-oxidanyl-4-oxidanylidene-butyl)benzoic acid

Systemtic Name: 4-(3-bromanyl-4-oxidanyl-4-oxidanylidene-butyl)benzoic acid Openeye Name: 4-(3-bromo-4-hydroxy-4-oxo-butyl)benzoic acid CAS Name: 4-(3-bromo-4-hydroxy-4-oxobutyl)benzoic acid IUPAC Name: 4-(3-bromo-4-hydroxy-4-oxobutyl)benzoic acid Traditional Name: 4-(3-bromo-4-hydroxy-4-keto-butyl)benzoic acid Formula: C11H11BrO4 MolecularWeight: 287.10664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(C(=O)O)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC(C(=O)O)Br)C(=O)O

InChI

InChI=1S/C11H11BrO4/c12-9(11(15)16)6-3-7-1-4-8(5-2-7)10(13)14/h1-2,4-5,9H,3,6H2,(H,13,14)(H,15,16)