(1R,2S)-2-(6-fluoranyl-2-oxidanyl-3-propanoyl-phenyl)cyclopropane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-(6-fluoranyl-2-oxidanyl-3-propanoyl-phenyl)cyclopropane-1-carboxylic acid Openeye Name: (1R,2S)-2-(6-fluoro-2-hydroxy-3-propanoyl-phenyl)cyclopropanecarboxylic acid CAS Name: (1R,2S)-2-[6-fluoro-2-hydroxy-3-(1-oxopropyl)phenyl]-1-cyclopropanecarboxylic acid IUPAC Name: (1R,2S)-2-(6-fluoro-2-hydroxy-3-propanoylphenyl)cyclopropane-1-carboxylic acid Traditional Name: (1R,2S)-2-(6-fluoro-2-hydroxy-3-propionyl-phenyl)cyclopropanecarboxylic acid Formula: C13H13FO4 MolecularWeight: 252.238323

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(=C(C=C1)F)C2CC2C(=O)O)O

Isomeric SMILES

CCC(=O)C1=C(C(=C(C=C1)F)[C@H]2C[C@H]2C(=O)O)O

InChI

InChI=1S/C13H13FO4/c1-2-10(15)6-3-4-9(14)11(12(6)16)7-5-8(7)13(17)18/h3-4,7-8,16H,2,5H2,1H3,(H,17,18)/t7-,8+/m0/s1