ethyl 1-[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(4-fluorophenyl)sulfonylpiperidine-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-(4-fluorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-fluorophenyl)sulfonylpiperidine-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(4-fluorophenyl)sulfonylnipecotoyl]isonipecotic acid ethyl ester Formula: C20H27FN2O5S MolecularWeight: 426.502183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H27FN2O5S/c1-2-28-20(25)15-9-12-22(13-10-15)19(24)16-4-3-11-23(14-16)29(26,27)18-7-5-17(21)6-8-18/h5-8,15-16H,2-4,9-14H2,1H3