N-[[(2S,4R)-1-ethyl-4-oxidanyl-pyrrolidin-2-yl]methyl]-5-iodanyl-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: N-[[(2S,4R)-1-ethyl-4-oxidanyl-pyrrolidin-2-yl]methyl]-5-iodanyl-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: N-[[(2S,4R)-1-ethyl-4-hydroxy-pyrrolidin-2-yl]methyl]-5-iodo-2,3-dihydrobenzofuran-7-carboxamide CAS Name: N-[[(2S,4R)-1-ethyl-4-hydroxy-2-pyrrolidinyl]methyl]-5-iodo-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: N-[[(2S,4R)-1-ethyl-4-hydroxypyrrolidin-2-yl]methyl]-5-iodo-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: N-[[(2S,4R)-1-ethyl-4-hydroxy-pyrrolidin-2-yl]methyl]-5-iodo-coumaran-7-carboxamide Formula: C16H21IN2O3 MolecularWeight: 416.25401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CC1CNC(=O)C2=CC(=CC3=C2OCC3)I)O

Isomeric SMILES

CCN1C[C@@H](C[C@H]1CNC(=O)C2=CC(=CC3=C2OCC3)I)O

InChI

InChI=1S/C16H21IN2O3/c1-2-19-9-13(20)7-12(19)8-18-16(21)14-6-11(17)5-10-3-4-22-15(10)14/h5-6,12-13,20H,2-4,7-9H2,1H3,(H,18,21)/t12-,13+/m0/s1