methyl 1-[3-(4-fluoranylphenoxy)propylsulfonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(4-fluoranylphenoxy)propylsulfonyl]piperidine-4-carboxylate Openeye Name: methyl 1-[3-(4-fluorophenoxy)propylsulfonyl]piperidine-4-carboxylate CAS Name: 1-[3-(4-fluorophenoxy)propylsulfonyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(4-fluorophenoxy)propylsulfonyl]piperidine-4-carboxylate Traditional Name: 1-[3-(4-fluorophenoxy)propylsulfonyl]isonipecotic acid methyl ester Formula: C16H22FNO5S MolecularWeight: 359.412983

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)S(=O)(=O)CCCOC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1CCN(CC1)S(=O)(=O)CCCOC2=CC=C(C=C2)F

InChI

InChI=1S/C16H22FNO5S/c1-22-16(19)13-7-9-18(10-8-13)24(20,21)12-2-11-23-15-5-3-14(17)4-6-15/h3-6,13H,2,7-12H2,1H3