ethyl 3-[[2,4-bis(fluoranyl)phenyl]methyl]-1-ethylsulfonyl-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[[2,4-bis(fluoranyl)phenyl]methyl]-1-ethylsulfonyl-piperidine-3-carboxylate Openeye Name: ethyl 3-[(2,4-difluorophenyl)methyl]-1-ethylsulfonyl-piperidine-3-carboxylate CAS Name: 3-[(2,4-difluorophenyl)methyl]-1-ethylsulfonyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-difluorophenyl)methyl]-1-ethylsulfonylpiperidine-3-carboxylate Traditional Name: 3-(2,4-difluorobenzyl)-1-esyl-nipecotic acid ethyl ester Formula: C17H23F2NO4S MolecularWeight: 375.430626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)S(=O)(=O)CC)CC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)S(=O)(=O)CC)CC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C17H23F2NO4S/c1-3-24-16(21)17(11-13-6-7-14(18)10-15(13)19)8-5-9-20(12-17)25(22,23)4-2/h6-7,10H,3-5,8-9,11-12H2,1-2H3