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

Systemtic Name: methyl 1-[4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[4-[(4-fluorophenyl)sulfonyl-methylamino]-1-oxobutyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(4-fluorophenyl)sulfonyl-methylamino]butanoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanoyl]-4-phenyl-isonipecotic acid methyl ester Formula: C24H29FN2O5S MolecularWeight: 476.560863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29FN2O5S/c1-26(33(30,31)21-12-10-20(25)11-13-21)16-6-9-22(28)27-17-14-24(15-18-27,23(29)32-2)19-7-4-3-5-8-19/h3-5,7-8,10-13H,6,9,14-18H2,1-2H3