(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(3,4-dimethoxyphenyl)ethanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(3,4-dimethoxyphenyl)ethanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 2-(3,4-dimethoxyphenyl)acetate CAS Name: 2-(3,4-dimethoxyphenyl)acetic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 2-(3,4-dimethoxyphenyl)acetate Traditional Name: 2-(3,4-dimethoxyphenyl)acetic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C20H17BrO6 MolecularWeight: 433.24938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)OC

InChI

InChI=1S/C20H17BrO6/c1-24-16-6-3-12(7-18(16)25-2)8-19(22)26-11-13-9-20(23)27-17-10-14(21)4-5-15(13)17/h3-7,9-10H,8,11H2,1-2H3