methyl 2-[5-[(4-bromanyl-2-fluoranyl-phenyl)methoxy]-4,7-dimethyl-2-oxidanylidene-chromen-3-yl]ethanoate

Systemtic Name: methyl 2-[5-[(4-bromanyl-2-fluoranyl-phenyl)methoxy]-4,7-dimethyl-2-oxidanylidene-chromen-3-yl]ethanoate Openeye Name: methyl 2-[5-[(4-bromo-2-fluoro-phenyl)methoxy]-4,7-dimethyl-2-oxo-chromen-3-yl]acetate CAS Name: 2-[5-[(4-bromo-2-fluorophenyl)methoxy]-4,7-dimethyl-2-oxo-1-benzopyran-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[(4-bromo-2-fluorophenyl)methoxy]-4,7-dimethyl-2-oxochromen-3-yl]acetate Traditional Name: 2-[5-(4-bromo-2-fluoro-benzyl)oxy-2-keto-4,7-dimethyl-chromen-3-yl]acetic acid methyl ester Formula: C21H18BrFO5 MolecularWeight: 449.267023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)OC)C)C(=C1)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)OC)C)C(=C1)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C21H18BrFO5/c1-11-6-17(27-10-13-4-5-14(22)8-16(13)23)20-12(2)15(9-19(24)26-3)21(25)28-18(20)7-11/h4-8H,9-10H2,1-3H3