1-[[3,4-bis(fluoranyl)phenyl]sulfonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[[3,4-bis(fluoranyl)phenyl]sulfonylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[(3,4-difluorophenyl)sulfonylamino]cyclohexanecarboxylic acid CAS Name: 1-[(3,4-difluorophenyl)sulfonylamino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(3,4-difluorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid Traditional Name: 1-[(3,4-difluorophenyl)sulfonylamino]cyclohexanecarboxylic acid Formula: C13H15F2NO4S MolecularWeight: 319.324306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

C1CCC(CC1)(C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H15F2NO4S/c14-10-5-4-9(8-11(10)15)21(19,20)16-13(12(17)18)6-2-1-3-7-13/h4-5,8,16H,1-3,6-7H2,(H,17,18)