cyanomethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: cyanomethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: cyanomethyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid cyanomethyl ester Formula: C12H14N2O4S2 MolecularWeight: 314.38056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC#N)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

C1CN(CCC1C(=O)OCC#N)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C12H14N2O4S2/c13-5-8-18-12(15)10-3-6-14(7-4-10)20(16,17)11-2-1-9-19-11/h1-2,9-10H,3-4,6-8H2