ethyl 1-[2-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(2-fluorophenyl)methyl-(p-tolylsulfonyl)amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(2-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2-fluorobenzyl)-tosyl-amino]acetyl]isonipecotic acid ethyl ester Formula: C24H29FN2O5S MolecularWeight: 476.560863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(CC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(CC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H29FN2O5S/c1-3-32-24(29)19-12-14-26(15-13-19)23(28)17-27(16-20-6-4-5-7-22(20)25)33(30,31)21-10-8-18(2)9-11-21/h4-11,19H,3,12-17H2,1-2H3