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

Systemtic Name: [2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 2-phenoxyethanoate Openeye Name: [2-(3-bromo-4,5-dimethoxy-phenyl)-4-oxo-chromen-3-yl] 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [2-(3-bromo-4,5-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3-bromo-4,5-dimethoxyphenyl)-4-oxochromen-3-yl] 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [2-(3-bromo-4,5-dimethoxy-phenyl)-4-keto-chromen-3-yl] ester Formula: C25H19BrO7 MolecularWeight: 511.31816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)COC4=CC=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)COC4=CC=CC=C4)Br)OC

InChI

InChI=1S/C25H19BrO7/c1-29-20-13-15(12-18(26)24(20)30-2)23-25(22(28)17-10-6-7-11-19(17)32-23)33-21(27)14-31-16-8-4-3-5-9-16/h3-13H,14H2,1-2H3