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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C)(C)C)OC3=CC=CC=C3Br

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C)(C)C)OC3=CC=CC=C3Br

InChI

InChI=1S/C21H19BrO5/c1-12-19(27-16-8-6-5-7-15(16)22)18(23)14-10-9-13(11-17(14)25-12)26-20(24)21(2,3)4/h5-11H,1-4H3