ethyl 1-[2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[N-(p-tolylsulfonyl)anilino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(N-(4-methylphenyl)sulfonylanilino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-tosylanilino)acetyl]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)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

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

InChI

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