ethyl 1-[1-[(4-fluorophenyl)methylsulfonyl]piperidin-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-[(4-fluorophenyl)methylsulfonyl]piperidin-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-[(4-fluorophenyl)methylsulfonyl]piperidine-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-[(4-fluorophenyl)methylsulfonyl]-4-piperidinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(4-fluorophenyl)methylsulfonyl]piperidine-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(4-fluorobenzyl)sulfonylisonipecotoyl]isonipecotic acid ethyl ester Formula: C21H29FN2O5S MolecularWeight: 440.528763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H29FN2O5S/c1-2-29-21(26)18-7-11-23(12-8-18)20(25)17-9-13-24(14-10-17)30(27,28)15-16-3-5-19(22)6-4-16/h3-6,17-18H,2,7-15H2,1H3