(2-oxidanylidene-4-propyl-chromen-7-yl) 2-(4-bromanylphenoxy)propanoate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) 2-(4-bromanylphenoxy)propanoate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) 2-(4-bromophenoxy)propanoate CAS Name: 2-(4-bromophenoxy)propanoic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) 2-(4-bromophenoxy)propanoate Traditional Name: 2-(4-bromophenoxy)propionic acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C21H19BrO5 MolecularWeight: 431.27656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C(C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C(C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H19BrO5/c1-3-4-14-11-20(23)27-19-12-17(9-10-18(14)19)26-21(24)13(2)25-16-7-5-15(22)6-8-16/h5-13H,3-4H2,1-2H3