1-cyanoethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: 1-cyanoethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: 1-cyanoethyl 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid 1-cyanoethyl ester Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4S/c1-11(9-15)21-14(18)12-4-7-17(8-5-12)22(19,20)13-3-2-6-16-10-13/h2-3,6,10-12H,4-5,7-8H2,1H3