6-(dimethylamino)-3-[[2-[(2-ethanoyl-4-fluoranyl-phenoxy)methyl]morpholin-4-yl]methyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 6-(dimethylamino)-3-[[2-[(2-ethanoyl-4-fluoranyl-phenoxy)methyl]morpholin-4-yl]methyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 3-[[2-[(2-acetyl-4-fluoro-phenoxy)methyl]morpholin-4-yl]methyl]-6-(dimethylamino)-2-fluoro-benzonitrile CAS Name: 3-[[2-[(2-acetyl-4-fluorophenoxy)methyl]-4-morpholinyl]methyl]-6-(dimethylamino)-2-fluorobenzonitrile IUPAC Name: 3-[[2-[(2-acetyl-4-fluorophenoxy)methyl]morpholin-4-yl]methyl]-6-(dimethylamino)-2-fluorobenzonitrile Traditional Name: 3-[[2-[(2-acetyl-4-fluoro-phenoxy)methyl]morpholino]methyl]-6-(dimethylamino)-2-fluoro-benzonitrile Formula: C23H25F2N3O3 MolecularWeight: 429.459706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)F)OCC2CN(CCO2)CC3=C(C(=C(C=C3)N(C)C)C#N)F

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)F)OCC2CN(CCO2)CC3=C(C(=C(C=C3)N(C)C)C#N)F

InChI

InChI=1S/C23H25F2N3O3/c1-15(29)19-10-17(24)5-7-22(19)31-14-18-13-28(8-9-30-18)12-16-4-6-21(27(2)3)20(11-26)23(16)25/h4-7,10,18H,8-9,12-14H2,1-3H3