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

Systemtic Name: 3-methylbutyl 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: isopentyl 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 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 2-[3-(2-bromophenoxy)-4-keto-chromen-7-yl]oxypropionic acid isoamyl ester Formula: C23H23BrO6 MolecularWeight: 475.32912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23BrO6/c1-14(2)10-11-27-23(26)15(3)29-16-8-9-17-20(12-16)28-13-21(22(17)25)30-19-7-5-4-6-18(19)24/h4-9,12-15H,10-11H2,1-3H3