ethanedioic acid; 4-fluoranyl-N-methyl-N-[4-[2-oxidanylidene-2-(pyridin-4-ylmethylamino)ethoxy]phenyl]benzamide

Systemtic Name: ethanedioic acid; 4-fluoranyl-N-methyl-N-[4-[2-oxidanylidene-2-(pyridin-4-ylmethylamino)ethoxy]phenyl]benzamide Openeye Name: 4-fluoro-N-methyl-N-[4-[2-oxo-2-(4-pyridylmethylamino)ethoxy]phenyl]benzamide; oxalic acid CAS Name: 4-fluoro-N-methyl-N-[4-[2-oxo-2-(pyridin-4-ylmethylamino)ethoxy]phenyl]benzamide; oxalic acid IUPAC Name: 4-fluoro-N-methyl-N-[4-[2-oxo-2-(pyridin-4-ylmethylamino)ethoxy]phenyl]benzamide; oxalic acid Traditional Name: 4-fluoro-N-[4-[2-keto-2-(4-pyridylmethylamino)ethoxy]phenyl]-N-methyl-benzamide; oxalic acid Formula: C24H22FN3O7 MolecularWeight: 483.445783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)NCC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)F.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)NCC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H20FN3O3.C2H2O4/c1-26(22(28)17-2-4-18(23)5-3-17)19-6-8-20(9-7-19)29-15-21(27)25-14-16-10-12-24-13-11-16;3-1(4)2(5)6/h2-13H,14-15H2,1H3,(H,25,27);(H,3,4)(H,5,6)