ethyl 1-[4-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(p-tolylsulfonylamino)methyl]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[(4-methylphenyl)sulfonylamino]methyl]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[(tosylamino)methyl]benzoyl]isonipecotic acid ethyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H28N2O5S/c1-3-30-23(27)20-12-14-25(15-13-20)22(26)19-8-6-18(7-9-19)16-24-31(28,29)21-10-4-17(2)5-11-21/h4-11,20,24H,3,12-16H2,1-2H3