ethyl 6-[(4-chloranyl-2-fluoranyl-phenyl)methylsulfonyl]cyclohexene-1-carboxylate

Systemtic Name: ethyl 6-[(4-chloranyl-2-fluoranyl-phenyl)methylsulfonyl]cyclohexene-1-carboxylate Openeye Name: ethyl 6-[(4-chloro-2-fluoro-phenyl)methylsulfonyl]cyclohexene-1-carboxylate CAS Name: 6-[(4-chloro-2-fluorophenyl)methylsulfonyl]-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-chloro-2-fluorophenyl)methylsulfonyl]cyclohexene-1-carboxylate Traditional Name: 6-(4-chloro-2-fluoro-benzyl)sulfonylcyclohexene-1-carboxylic acid ethyl ester Formula: C16H18ClFO4S MolecularWeight: 360.828123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCCCC1S(=O)(=O)CC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CCOC(=O)C1=CCCCC1S(=O)(=O)CC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C16H18ClFO4S/c1-2-22-16(19)13-5-3-4-6-15(13)23(20,21)10-11-7-8-12(17)9-14(11)18/h5,7-9,15H,2-4,6,10H2,1H3