methyl 1-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(2-chloro-6-fluorophenyl)methylthio]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2-chloro-6-fluoro-benzyl)thio]acetyl]isonipecotic acid methyl ester Formula: C16H19ClFNO3S MolecularWeight: 359.843363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSCC2=C(C=CC=C2Cl)F

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C16H19ClFNO3S/c1-22-16(21)11-5-7-19(8-6-11)15(20)10-23-9-12-13(17)3-2-4-14(12)18/h2-4,11H,5-10H2,1H3