ethyl 1-[4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[(2-fluorophenyl)methyl-methylsulfonylamino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[(2-fluorobenzyl)-mesyl-amino]benzoyl]isonipecotic acid ethyl ester Formula: C23H27FN2O5S MolecularWeight: 462.534283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3F)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=CC=C3F)S(=O)(=O)C

InChI

InChI=1S/C23H27FN2O5S/c1-3-31-23(28)18-12-14-25(15-13-18)22(27)17-8-10-20(11-9-17)26(32(2,29)30)16-19-6-4-5-7-21(19)24/h4-11,18H,3,12-16H2,1-2H3