ethyl 6-[(2-fluorophenyl)methylsulfonyl]cyclohexene-1-carboxylate

Systemtic Name: ethyl 6-[(2-fluorophenyl)methylsulfonyl]cyclohexene-1-carboxylate Openeye Name: ethyl 6-[(2-fluorophenyl)methylsulfonyl]cyclohexene-1-carboxylate CAS Name: 6-[(2-fluorophenyl)methylsulfonyl]-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2-fluorophenyl)methylsulfonyl]cyclohexene-1-carboxylate Traditional Name: 6-(2-fluorobenzyl)sulfonylcyclohexene-1-carboxylic acid ethyl ester Formula: C16H19FO4S MolecularWeight: 326.383063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCCCC1S(=O)(=O)CC2=CC=CC=C2F

Isomeric SMILES

CCOC(=O)C1=CCCCC1S(=O)(=O)CC2=CC=CC=C2F

InChI

InChI=1S/C16H19FO4S/c1-2-21-16(18)13-8-4-6-10-15(13)22(19,20)11-12-7-3-5-9-14(12)17/h3,5,7-9,15H,2,4,6,10-11H2,1H3