(2-chloranyl-4-fluoranyl-phenyl)sulfamoyl 3-tert-butyl-2-ethyl-cyclohexene-1-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)sulfamoyl 3-tert-butyl-2-ethyl-cyclohexene-1-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)sulfamoyl 3-tert-butyl-2-ethyl-cyclohexene-1-carboxylate CAS Name: 3-tert-butyl-2-ethyl-1-cyclohexenecarboxylic acid (2-chloro-4-fluorophenyl)sulfamoyl ester IUPAC Name: (2-chloro-4-fluorophenyl)sulfamoyl 3-tert-butyl-2-ethylcyclohexene-1-carboxylate Traditional Name: 3-tert-butyl-2-ethyl-cyclohexene-1-carboxylic acid (2-chloro-4-fluoro-phenyl)sulfamoyl ester Formula: C19H25ClFNO4S MolecularWeight: 417.922503

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(CCCC1C(C)(C)C)C(=O)OS(=O)(=O)NC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CCC1=C(CCCC1C(C)(C)C)C(=O)OS(=O)(=O)NC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C19H25ClFNO4S/c1-5-13-14(7-6-8-15(13)19(2,3)4)18(23)26-27(24,25)22-17-10-9-12(21)11-16(17)20/h9-11,15,22H,5-8H2,1-4H3