N-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-2-fluoranyl-4-phenoxy-benzamide

Systemtic Name: N-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-2-fluoranyl-4-phenoxy-benzamide Openeye Name: N-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-2-fluoro-4-phenoxy-benzamide CAS Name: N-[4-[3-(dimethylamino)-1-pyrrolidinyl]phenyl]-2-fluoro-4-phenoxybenzamide IUPAC Name: N-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-2-fluoro-4-phenoxybenzamide Traditional Name: N-[4-[3-(dimethylamino)pyrrolidino]phenyl]-2-fluoro-4-phenoxy-benzamide Formula: C25H26FN3O2 MolecularWeight: 419.491243

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(C1)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)OC4=CC=CC=C4)F

Isomeric SMILES

CN(C)C1CCN(C1)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)OC4=CC=CC=C4)F

InChI

InChI=1S/C25H26FN3O2/c1-28(2)20-14-15-29(17-20)19-10-8-18(9-11-19)27-25(30)23-13-12-22(16-24(23)26)31-21-6-4-3-5-7-21/h3-13,16,20H,14-15,17H2,1-2H3,(H,27,30)