1-(3-chloranyl-2-fluoranyl-phenyl)sulfonylpiperidine-2-carboxylic acid

Systemtic Name: 1-(3-chloranyl-2-fluoranyl-phenyl)sulfonylpiperidine-2-carboxylic acid Openeye Name: 1-(3-chloro-2-fluoro-phenyl)sulfonylpiperidine-2-carboxylic acid CAS Name: 1-(3-chloro-2-fluorophenyl)sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 1-(3-chloro-2-fluorophenyl)sulfonylpiperidine-2-carboxylic acid Traditional Name: 1-(3-chloro-2-fluoro-phenyl)sulfonylpipecolinic acid Formula: C12H13ClFNO4S MolecularWeight: 321.752323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=C(C(=CC=C2)Cl)F

Isomeric SMILES

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=C(C(=CC=C2)Cl)F

InChI

InChI=1S/C12H13ClFNO4S/c13-8-4-3-6-10(11(8)14)20(18,19)15-7-2-1-5-9(15)12(16)17/h3-4,6,9H,1-2,5,7H2,(H,16,17)