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

Systemtic Name: ethyl 3-[[2,4-bis(fluoranyl)phenyl]methyl]-1-propanoyl-piperidine-3-carboxylate Openeye Name: ethyl 3-[(2,4-difluorophenyl)methyl]-1-propanoyl-piperidine-3-carboxylate CAS Name: 3-[(2,4-difluorophenyl)methyl]-1-(1-oxopropyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-difluorophenyl)methyl]-1-propanoylpiperidine-3-carboxylate Traditional Name: 3-(2,4-difluorobenzyl)-1-propionyl-nipecotic acid ethyl ester Formula: C18H23F2NO3 MolecularWeight: 339.376926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCCC(C1)(CC2=C(C=C(C=C2)F)F)C(=O)OCC

Isomeric SMILES

CCC(=O)N1CCCC(C1)(CC2=C(C=C(C=C2)F)F)C(=O)OCC

InChI

InChI=1S/C18H23F2NO3/c1-3-16(22)21-9-5-8-18(12-21,17(23)24-4-2)11-13-6-7-14(19)10-15(13)20/h6-7,10H,3-5,8-9,11-12H2,1-2H3