methyl 1-[2-[(4-fluorophenyl)carbonylamino]ethylsulfonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(4-fluorophenyl)carbonylamino]ethylsulfonyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(4-fluorobenzoyl)amino]ethylsulfonyl]piperidine-4-carboxylate CAS Name: 1-[2-[[(4-fluorophenyl)-oxomethyl]amino]ethylsulfonyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(4-fluorobenzoyl)amino]ethylsulfonyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-fluorobenzoyl)amino]ethylsulfonyl]isonipecotic acid methyl ester Formula: C16H21FN2O5S MolecularWeight: 372.411743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21FN2O5S/c1-24-16(21)13-6-9-19(10-7-13)25(22,23)11-8-18-15(20)12-2-4-14(17)5-3-12/h2-5,13H,6-11H2,1H3,(H,18,20)