[3-(2-bromanylphenoxy)-4-oxidanylidene-chromen-7-yl] 3,3-dimethylbutanoate

Systemtic Name: [3-(2-bromanylphenoxy)-4-oxidanylidene-chromen-7-yl] 3,3-dimethylbutanoate Openeye Name: [3-(2-bromophenoxy)-4-oxo-chromen-7-yl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [3-(2-bromophenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-bromophenoxy)-4-oxochromen-7-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [3-(2-bromophenoxy)-4-keto-chromen-7-yl] ester Formula: C21H19BrO5 MolecularWeight: 431.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Br

Isomeric SMILES

CC(C)(C)CC(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Br

InChI

InChI=1S/C21H19BrO5/c1-21(2,3)11-19(23)26-13-8-9-14-17(10-13)25-12-18(20(14)24)27-16-7-5-4-6-15(16)22/h4-10,12H,11H2,1-3H3