N-[(2-ethoxypyridin-3-yl)methyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2-ethoxypyridin-3-yl)methyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(2-ethoxy-3-pyridyl)methyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[(2-ethoxy-3-pyridinyl)methyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2-ethoxypyridin-3-yl)methyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: 1-esyl-N-[(2-ethoxy-3-pyridyl)methyl]isonipecotamide Formula: C16H25N3O4S MolecularWeight: 355.4524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC

Isomeric SMILES

CCOC1=C(C=CC=N1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC

InChI

InChI=1S/C16H25N3O4S/c1-3-23-16-14(6-5-9-17-16)12-18-15(20)13-7-10-19(11-8-13)24(21,22)4-2/h5-6,9,13H,3-4,7-8,10-12H2,1-2H3,(H,18,20)