[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate Openeye Name: [2-(3,4-dimethoxyphenyl)-4-oxo-chromen-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-(3,4-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-4-oxochromen-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-(3,4-dimethoxyphenyl)-4-keto-chromen-3-yl] ester Formula: C24H17BrO6 MolecularWeight: 481.29218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H17BrO6/c1-28-19-11-10-14(13-20(19)29-2)22-23(21(26)17-8-3-4-9-18(17)30-22)31-24(27)15-6-5-7-16(25)12-15/h3-13H,1-2H3