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

Systemtic Name: ethyl 3-[7-[(4-bromanyl-2-fluoranyl-phenyl)methoxy]-6-chloranyl-4-methyl-2-oxidanylidene-chromen-3-yl]propanoate Openeye Name: ethyl 3-[7-[(4-bromo-2-fluoro-phenyl)methoxy]-6-chloro-4-methyl-2-oxo-chromen-3-yl]propanoate CAS Name: 3-[7-[(4-bromo-2-fluorophenyl)methoxy]-6-chloro-4-methyl-2-oxo-1-benzopyran-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[7-[(4-bromo-2-fluorophenyl)methoxy]-6-chloro-4-methyl-2-oxochromen-3-yl]propanoate Traditional Name: 3-[7-(4-bromo-2-fluoro-benzyl)oxy-6-chloro-2-keto-4-methyl-chromen-3-yl]propionic acid ethyl ester Formula: C22H19BrClFO5 MolecularWeight: 497.738663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=C(C=C(C=C3)Br)F)Cl)C

Isomeric SMILES

CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=C(C=C(C=C3)Br)F)Cl)C

InChI

InChI=1S/C22H19BrClFO5/c1-3-28-21(26)7-6-15-12(2)16-9-17(24)20(10-19(16)30-22(15)27)29-11-13-4-5-14(23)8-18(13)25/h4-5,8-10H,3,6-7,11H2,1-2H3