methyl 2-[4-(4-bromophenyl)-4-fluoranyl-piperidin-1-yl]sulfonylethanoate

Systemtic Name: methyl 2-[4-(4-bromophenyl)-4-fluoranyl-piperidin-1-yl]sulfonylethanoate Openeye Name: methyl 2-[[4-(4-bromophenyl)-4-fluoro-1-piperidyl]sulfonyl]acetate CAS Name: 2-[[4-(4-bromophenyl)-4-fluoro-1-piperidinyl]sulfonyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-bromophenyl)-4-fluoropiperidin-1-yl]sulfonylacetate Traditional Name: 2-[4-(4-bromophenyl)-4-fluoro-piperidino]sulfonylacetic acid methyl ester Formula: C14H17BrFNO4S MolecularWeight: 394.256483

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CS(=O)(=O)N1CCC(CC1)(C2=CC=C(C=C2)Br)F

Isomeric SMILES

COC(=O)CS(=O)(=O)N1CCC(CC1)(C2=CC=C(C=C2)Br)F

InChI

InChI=1S/C14H17BrFNO4S/c1-21-13(18)10-22(19,20)17-8-6-14(16,7-9-17)11-2-4-12(15)5-3-11/h2-5H,6-10H2,1H3