methyl 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-(3-chloro-4-fluoro-phenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-chloro-4-fluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonylisonipecotic acid methyl ester Formula: C13H15ClFNO4S MolecularWeight: 335.778903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

COC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H15ClFNO4S/c1-20-13(17)9-4-6-16(7-5-9)21(18,19)10-2-3-12(15)11(14)8-10/h2-3,8-9H,4-7H2,1H3