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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H28N2O5S/c1-4-30-23(27)19-13-15-25(16-14-19)22(26)18-7-9-20(10-8-18)24(3)31(28,29)21-11-5-17(2)6-12-21/h5-12,19H,4,13-16H2,1-3H3