ethyl 1-[2-[(4-ethoxyphenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-ethoxyphenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-ethoxy-N-methylsulfonyl-anilino)propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-(4-ethoxy-N-methylsulfonylanilino)-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-ethoxy-N-methylsulfonylanilino)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-ethoxy-N-mesyl-anilino)propanoyl]isonipecotic acid ethyl ester Formula: C20H30N2O6S MolecularWeight: 426.527

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(C)C(=O)N2CCC(CC2)C(=O)OCC)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C(C)C(=O)N2CCC(CC2)C(=O)OCC)S(=O)(=O)C

InChI

InChI=1S/C20H30N2O6S/c1-5-27-18-9-7-17(8-10-18)22(29(4,25)26)15(3)19(23)21-13-11-16(12-14-21)20(24)28-6-2/h7-10,15-16H,5-6,11-14H2,1-4H3