ethyl 2-[2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl]oxyethanoate

Systemtic Name: ethyl 2-[2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl]oxyethanoate Openeye Name: ethyl 2-[2-(3-bromo-4,5-dimethoxy-phenyl)-4-oxo-chromen-3-yl]oxyacetate CAS Name: 2-[[2-(3-bromo-4,5-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-bromo-4,5-dimethoxyphenyl)-4-oxochromen-3-yl]oxyacetate Traditional Name: 2-[2-(3-bromo-4,5-dimethoxy-phenyl)-4-keto-chromen-3-yl]oxyacetic acid ethyl ester Formula: C21H19BrO7 MolecularWeight: 463.27536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(OC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)Br)OC)OC

Isomeric SMILES

CCOC(=O)COC1=C(OC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)Br)OC)OC

InChI

InChI=1S/C21H19BrO7/c1-4-27-17(23)11-28-21-18(24)13-7-5-6-8-15(13)29-19(21)12-9-14(22)20(26-3)16(10-12)25-2/h5-10H,4,11H2,1-3H3