ethyl 3-[7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]propanoate

Systemtic Name: ethyl 3-[7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]propanoate Openeye Name: ethyl 3-[7-[(2-chloro-6-fluoro-phenyl)methoxy]-4-methyl-2-oxo-chromen-3-yl]propanoate CAS Name: 3-[7-[(2-chloro-6-fluorophenyl)methoxy]-4-methyl-2-oxo-1-benzopyran-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[7-[(2-chloro-6-fluorophenyl)methoxy]-4-methyl-2-oxochromen-3-yl]propanoate Traditional Name: 3-[7-(2-chloro-6-fluoro-benzyl)oxy-2-keto-4-methyl-chromen-3-yl]propionic acid ethyl ester Formula: C22H20ClFO5 MolecularWeight: 418.842603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=C(C=CC=C3Cl)F)OC1=O)C

Isomeric SMILES

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=C(C=CC=C3Cl)F)OC1=O)C

InChI

InChI=1S/C22H20ClFO5/c1-3-27-21(25)10-9-16-13(2)15-8-7-14(11-20(15)29-22(16)26)28-12-17-18(23)5-4-6-19(17)24/h4-8,11H,3,9-10,12H2,1-2H3