2-(1,3-benzodioxol-5-yloxy)-N-[[2-fluoranyl-4-(2-oxidanylpropan-2-yl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yloxy)-N-[[2-fluoranyl-4-(2-oxidanylpropan-2-yl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yloxy)-N-[[2-fluoro-4-(1-hydroxy-1-methyl-ethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yloxy)-N-[[2-fluoro-4-(2-hydroxypropan-2-yl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yloxy)-N-[[2-fluoro-4-(2-hydroxypropan-2-yl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yloxy)-N-[2-fluoro-4-(1-hydroxy-1-methyl-ethyl)benzyl]nicotinamide Formula: C23H21FN2O5 MolecularWeight: 424.421643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C(C=C1)CNC(=O)C2=C(N=CC=C2)OC3=CC4=C(C=C3)OCO4)F)O

Isomeric SMILES

CC(C)(C1=CC(=C(C=C1)CNC(=O)C2=C(N=CC=C2)OC3=CC4=C(C=C3)OCO4)F)O

InChI

InChI=1S/C23H21FN2O5/c1-23(2,28)15-6-5-14(18(24)10-15)12-26-21(27)17-4-3-9-25-22(17)31-16-7-8-19-20(11-16)30-13-29-19/h3-11,28H,12-13H2,1-2H3,(H,26,27)