(phenylmethyl) 2-[2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl]oxyethanoate

Systemtic Name: (phenylmethyl) 2-[2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl]oxyethanoate Openeye Name: benzyl 2-[2-(3-bromo-4-methoxy-phenyl)-4-oxo-chromen-3-yl]oxyacetate CAS Name: 2-[[2-(3-bromo-4-methoxyphenyl)-4-oxo-1-benzopyran-3-yl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(3-bromo-4-methoxyphenyl)-4-oxochromen-3-yl]oxyacetate Traditional Name: 2-[2-(3-bromo-4-methoxy-phenyl)-4-keto-chromen-3-yl]oxyacetic acid benzyl ester Formula: C25H19BrO6 MolecularWeight: 495.31876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OCC(=O)OCC4=CC=CC=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OCC(=O)OCC4=CC=CC=C4)Br

InChI

InChI=1S/C25H19BrO6/c1-29-21-12-11-17(13-19(21)26)24-25(23(28)18-9-5-6-10-20(18)32-24)31-15-22(27)30-14-16-7-3-2-4-8-16/h2-13H,14-15H2,1H3