5-chloranyl-2-oxidanyl-3-propanoyl-benzoic acid

Systemtic Name: 5-chloranyl-2-oxidanyl-3-propanoyl-benzoic acid Openeye Name: 5-chloro-2-hydroxy-3-propanoyl-benzoic acid CAS Name: 5-chloro-2-hydroxy-3-(1-oxopropyl)benzoic acid IUPAC Name: 5-chloro-2-hydroxy-3-propanoylbenzoic acid Traditional Name: 5-chloro-2-hydroxy-3-propionyl-benzoic acid Formula: C10H9ClO4 MolecularWeight: 228.62906

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC(=C1O)C(=O)O)Cl

Isomeric SMILES

CCC(=O)C1=CC(=CC(=C1O)C(=O)O)Cl

InChI

InChI=1S/C10H9ClO4/c1-2-8(12)6-3-5(11)4-7(9(6)13)10(14)15/h3-4,13H,2H2,1H3,(H,14,15)