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

Systemtic Name: ethyl 3-[7-[(4-bromanyl-2-fluoranyl-phenyl)methoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]propanoate Openeye Name: ethyl 3-[7-[(4-bromo-2-fluoro-phenyl)methoxy]-4-methyl-2-oxo-chromen-3-yl]propanoate CAS Name: 3-[7-[(4-bromo-2-fluorophenyl)methoxy]-4-methyl-2-oxo-1-benzopyran-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[7-[(4-bromo-2-fluorophenyl)methoxy]-4-methyl-2-oxochromen-3-yl]propanoate Traditional Name: 3-[7-(4-bromo-2-fluoro-benzyl)oxy-2-keto-4-methyl-chromen-3-yl]propionic acid ethyl ester Formula: C22H20BrFO5 MolecularWeight: 463.293603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=C(C=C(C=C3)Br)F)OC1=O)C

Isomeric SMILES

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=C(C=C(C=C3)Br)F)OC1=O)C

InChI

InChI=1S/C22H20BrFO5/c1-3-27-21(25)9-8-18-13(2)17-7-6-16(11-20(17)29-22(18)26)28-12-14-4-5-15(23)10-19(14)24/h4-7,10-11H,3,8-9,12H2,1-2H3