3-(2-chloranyl-6-fluoranyl-phenyl)-1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]prop-2-en-1-one

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]prop-2-en-1-one Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]prop-2-en-1-one CAS Name: 3-(2-chloro-6-fluorophenyl)-1-[2-[(3-ethynylphenoxy)methyl]-4-morpholinyl]-2-propen-1-one IUPAC Name: 3-(2-chloro-6-fluorophenyl)-1-[2-[(3-ethynylphenoxy)methyl]morpholin-4-yl]prop-2-en-1-one Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-1-[2-[(3-ethynylphenoxy)methyl]morpholino]prop-2-en-1-one Formula: C22H19ClFNO3 MolecularWeight: 399.842563

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)C=CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C#CC1=CC(=CC=C1)OCC2CN(CCO2)C(=O)C=CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H19ClFNO3/c1-2-16-5-3-6-17(13-16)28-15-18-14-25(11-12-27-18)22(26)10-9-19-20(23)7-4-8-21(19)24/h1,3-10,13,18H,11-12,14-15H2