2-methylpropyl 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate

Systemtic Name: 2-methylpropyl 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: isobutyl 2-[3-(2-bromophenoxy)-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(2-bromophenoxy)-4-oxo-1-benzopyran-7-yl]oxy]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 2-[3-(2-bromophenoxy)-4-keto-chromen-7-yl]oxypropionic acid isobutyl ester Formula: C22H21BrO6 MolecularWeight: 461.30254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrO6/c1-13(2)11-27-22(25)14(3)28-15-8-9-16-19(10-15)26-12-20(21(16)24)29-18-7-5-4-6-17(18)23/h4-10,12-14H,11H2,1-3H3