3,4,5-tris(oxidanyl)-N-[3-(pyridin-3-ylmethoxy)phenyl]cyclohexene-1-carboxamide

Systemtic Name: 3,4,5-tris(oxidanyl)-N-[3-(pyridin-3-ylmethoxy)phenyl]cyclohexene-1-carboxamide Openeye Name: 3,4,5-trihydroxy-N-[3-(3-pyridylmethoxy)phenyl]cyclohexene-1-carboxamide CAS Name: 3,4,5-trihydroxy-N-[3-(3-pyridinylmethoxy)phenyl]-1-cyclohexenecarboxamide IUPAC Name: 3,4,5-trihydroxy-N-[3-(pyridin-3-ylmethoxy)phenyl]cyclohexene-1-carboxamide Traditional Name: 3,4,5-trihydroxy-N-[3-(3-pyridylmethoxy)phenyl]cyclohexene-1-carboxamide Formula: C19H20N2O5 MolecularWeight: 356.3725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C=C1C(=O)NC2=CC(=CC=C2)OCC3=CN=CC=C3)O)O)O

Isomeric SMILES

C1C(C(C(C=C1C(=O)NC2=CC(=CC=C2)OCC3=CN=CC=C3)O)O)O

InChI

InChI=1S/C19H20N2O5/c22-16-7-13(8-17(23)18(16)24)19(25)21-14-4-1-5-15(9-14)26-11-12-3-2-6-20-10-12/h1-7,9-10,16-18,22-24H,8,11H2,(H,21,25)