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

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)sulfamoyl 2-ethyl-3-phenyl-cyclohexene-1-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)sulfamoyl 2-ethyl-3-phenyl-cyclohexene-1-carboxylate CAS Name: 2-ethyl-3-phenyl-1-cyclohexenecarboxylic acid (2-chloro-4-fluorophenyl)sulfamoyl ester IUPAC Name: (2-chloro-4-fluorophenyl)sulfamoyl 2-ethyl-3-phenylcyclohexene-1-carboxylate Traditional Name: 2-ethyl-3-phenyl-cyclohexene-1-carboxylic acid (2-chloro-4-fluoro-phenyl)sulfamoyl ester Formula: C21H21ClFNO4S MolecularWeight: 437.912143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(CCCC1C2=CC=CC=C2)C(=O)OS(=O)(=O)NC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCC1=C(CCCC1C2=CC=CC=C2)C(=O)OS(=O)(=O)NC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFNO4S/c1-2-16-17(14-7-4-3-5-8-14)9-6-10-18(16)21(25)28-29(26,27)24-20-12-11-15(23)13-19(20)22/h3-5,7-8,11-13,17,24H,2,6,9-10H2,1H3