(6-chloranylpyridin-3-yl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid (6-chloro-3-pyridyl)methyl ester Formula: C16H17ClN2O4S2 MolecularWeight: 400.90018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CN=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CN=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H17ClN2O4S2/c17-14-4-3-12(10-18-14)11-23-16(20)13-5-7-19(8-6-13)25(21,22)15-2-1-9-24-15/h1-4,9-10,13H,5-8,11H2