(2-oxidanylidene-2-piperidin-1-yl-ethyl) (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]propionic acid (2-keto-2-piperidino-ethyl) ester Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)N1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)N1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C18H25N3O6S/c1-13(18(24)27-12-17(23)21-10-4-3-5-11-21)20-28(25,26)16-8-6-15(7-9-16)19-14(2)22/h6-9,13,20H,3-5,10-12H2,1-2H3,(H,19,22)/t13-/m0/s1