2-(3-bromanyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoate

Systemtic Name: 2-(3-bromanyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoate Openeye Name: 2-(3-bromo-2-oxo-4-propyl-chromen-7-yl)oxyacetate CAS Name: 2-[(3-bromo-2-oxo-4-propyl-1-benzopyran-7-yl)oxy]acetate IUPAC Name: 2-(3-bromo-2-oxo-4-propylchromen-7-yl)oxyacetate Traditional Name: 2-(3-bromo-2-keto-4-propyl-chromen-7-yl)oxyacetate Formula: C14H12BrO5- MolecularWeight: 340.14608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)[O-])Br

Isomeric SMILES

CCCC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)[O-])Br

InChI

InChI=1S/C14H13BrO5/c1-2-3-10-9-5-4-8(19-7-12(16)17)6-11(9)20-14(18)13(10)15/h4-6H,2-3,7H2,1H3,(H,16,17)/p-1