[(1R)-1-cyanoethyl] 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [(1R)-1-cyanoethyl] 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [(1R)-1-cyanoethyl] 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3-acetylphenyl)sulfonyl-4-piperidinecarboxylic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-acetylphenyl)sulfonylisonipecotic acid [(1R)-1-cyanoethyl] ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C

Isomeric SMILES

C[C@H](C#N)OC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C

InChI

InChI=1S/C17H20N2O5S/c1-12(11-18)24-17(21)14-6-8-19(9-7-14)25(22,23)16-5-3-4-15(10-16)13(2)20/h3-5,10,12,14H,6-9H2,1-2H3/t12-/m1/s1