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

Systemtic Name: methyl 1-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[2-[(4-fluorophenyl)sulfonyl-methylamino]-1-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(4-fluorophenyl)sulfonyl-methylamino]acetyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]-4-phenyl-isonipecotic acid methyl ester Formula: C22H25FN2O5S MolecularWeight: 448.507703

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O5S/c1-24(31(28,29)19-10-8-18(23)9-11-19)16-20(26)25-14-12-22(13-15-25,21(27)30-2)17-6-4-3-5-7-17/h3-11H,12-16H2,1-2H3