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

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid (6-chloro-3-pyridyl)methyl ester Formula: C17H18ClN3O4S MolecularWeight: 395.86052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClN3O4S/c18-16-4-3-13(10-20-16)12-25-17(22)14-5-8-21(9-6-14)26(23,24)15-2-1-7-19-11-15/h1-4,7,10-11,14H,5-6,8-9,12H2