1-[2-bromanyl-4,6-bis(fluoranyl)phenyl]sulfonylpiperidine-3-carboxylic acid

Systemtic Name: 1-[2-bromanyl-4,6-bis(fluoranyl)phenyl]sulfonylpiperidine-3-carboxylic acid Openeye Name: 1-(2-bromo-4,6-difluoro-phenyl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-(2-bromo-4,6-difluorophenyl)sulfonyl-3-piperidinecarboxylic acid IUPAC Name: 1-(2-bromo-4,6-difluorophenyl)sulfonylpiperidine-3-carboxylic acid Traditional Name: 1-(2-bromo-4,6-difluoro-phenyl)sulfonylnipecotic acid Formula: C12H12BrF2NO4S MolecularWeight: 384.193786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=C(C=C(C=C2Br)F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=C(C=C(C=C2Br)F)F)C(=O)O

InChI

InChI=1S/C12H12BrF2NO4S/c13-9-4-8(14)5-10(15)11(9)21(19,20)16-3-1-2-7(6-16)12(17)18/h4-5,7H,1-3,6H2,(H,17,18)