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

Systemtic Name: N-[[4-(1-azanyl-1-oxidanylidene-propan-2-yl)oxy-2-fluoranyl-phenyl]methyl]-2-(1,3-benzodioxol-5-yloxy)pyridine-3-carboxamide Openeye Name: N-[[4-(2-amino-1-methyl-2-oxo-ethoxy)-2-fluoro-phenyl]methyl]-2-(1,3-benzodioxol-5-yloxy)pyridine-3-carboxamide CAS Name: N-[[4-(1-amino-1-oxopropan-2-yl)oxy-2-fluorophenyl]methyl]-2-(1,3-benzodioxol-5-yloxy)-3-pyridinecarboxamide IUPAC Name: N-[[4-(1-amino-1-oxopropan-2-yl)oxy-2-fluorophenyl]methyl]-2-(1,3-benzodioxol-5-yloxy)pyridine-3-carboxamide Traditional Name: N-[4-(2-amino-2-keto-1-methyl-ethoxy)-2-fluoro-benzyl]-2-(1,3-benzodioxol-5-yloxy)nicotinamide Formula: C23H20FN3O6 MolecularWeight: 453.419803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC1=CC(=C(C=C1)CNC(=O)C2=C(N=CC=C2)OC3=CC4=C(C=C3)OCO4)F

Isomeric SMILES

CC(C(=O)N)OC1=CC(=C(C=C1)CNC(=O)C2=C(N=CC=C2)OC3=CC4=C(C=C3)OCO4)F

InChI

InChI=1S/C23H20FN3O6/c1-13(21(25)28)32-15-5-4-14(18(24)9-15)11-27-22(29)17-3-2-8-26-23(17)33-16-6-7-19-20(10-16)31-12-30-19/h2-10,13H,11-12H2,1H3,(H2,25,28)(H,27,29)