[(1S)-2-oxidanylidenecyclohexyl] (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: [(1S)-2-oxocyclohexyl] (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] (2S)-2-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]propionic acid [(1S)-2-ketocyclohexyl] ester Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCCC1=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)O[C@H]1CCCCC1=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C17H22N2O6S/c1-11(17(22)25-16-6-4-3-5-15(16)21)19-26(23,24)14-9-7-13(8-10-14)18-12(2)20/h7-11,16,19H,3-6H2,1-2H3,(H,18,20)/t11-,16-/m0/s1