ethyl 1-[4-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[4-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[4-[(p-tolylsulfonylamino)methyl]benzoyl]piperidine-3-carboxylate CAS Name: 1-[[4-[[(4-methylphenyl)sulfonylamino]methyl]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[(4-methylphenyl)sulfonylamino]methyl]benzoyl]piperidine-3-carboxylate Traditional Name: 1-[4-[(tosylamino)methyl]benzoyl]nipecotic acid ethyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)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)20-5-4-14-25(16-20)22(26)19-10-8-18(9-11-19)15-24-31(28,29)21-12-6-17(2)7-13-21/h6-13,20,24H,3-5,14-16H2,1-2H3