(2-oxidanylidene-2-piperidin-1-yl-ethyl) 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propionic acid (2-keto-2-piperidino-ethyl) ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NCCC(=O)OCC(=O)N2CCCCC2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NCCC(=O)OCC(=O)N2CCCCC2)C)C

InChI

InChI=1S/C20H30N2O5S/c1-14-12-15(2)17(4)20(16(14)3)28(25,26)21-9-8-19(24)27-13-18(23)22-10-6-5-7-11-22/h12,21H,5-11,13H2,1-4H3