[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-[5-methoxy-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]methanone

Systemtic Name: [2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-[5-methoxy-2-[2,2,2-tris(fluoranyl)ethoxy]phenyl]methanone Openeye Name: [2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-[5-methoxy-2-(2,2,2-trifluoroethoxy)phenyl]methanone CAS Name: [2-[(3-ethynylphenoxy)methyl]-4-morpholinyl]-[5-methoxy-2-(2,2,2-trifluoroethoxy)phenyl]methanone IUPAC Name: [2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]-[5-methoxy-2-(2,2,2-trifluoroethoxy)phenyl]methanone Traditional Name: [2-[(3-ethynylphenoxy)methyl]morpholino]-[5-methoxy-2-(2,2,2-trifluoroethoxy)phenyl]methanone Formula: C23H22F3NO5 MolecularWeight: 449.41969

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(F)(F)F)C(=O)N2CCOC(C2)COC3=CC=CC(=C3)C#C

Isomeric SMILES

COC1=CC(=C(C=C1)OCC(F)(F)F)C(=O)N2CCOC(C2)COC3=CC=CC(=C3)C#C

InChI

InChI=1S/C23H22F3NO5/c1-3-16-5-4-6-18(11-16)31-14-19-13-27(9-10-30-19)22(28)20-12-17(29-2)7-8-21(20)32-15-23(24,25)26/h1,4-8,11-12,19H,9-10,13-15H2,2H3