1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidine-2-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidine-2-carboxylic acid Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonylpiperidine-2-carboxylic acid CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonylpiperidine-2-carboxylic acid Traditional Name: 1-(3-chloro-4-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=CC(=C(C=C2)F)Cl

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClFNO4S/c13-9-7-8(4-5-10(9)14)20(18,19)15-6-2-1-3-11(15)12(16)17/h4-5,7,11H,1-3,6H2,(H,16,17)