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

Systemtic Name: (phenylmethyl) 2-[2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl]oxyethanoate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C26H21BrO7 MolecularWeight: 525.34474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C(C(=O)C3=CC=CC=C3O2)OCC(=O)OCC4=CC=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C(C(=O)C3=CC=CC=C3O2)OCC(=O)OCC4=CC=CC=C4)Br)OC

InChI

InChI=1S/C26H21BrO7/c1-30-21-13-17(12-19(27)25(21)31-2)24-26(23(29)18-10-6-7-11-20(18)34-24)33-15-22(28)32-14-16-8-4-3-5-9-16/h3-13H,14-15H2,1-2H3