(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-bromanylphenoxy)ethanoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-bromanylphenoxy)ethanoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 2-(4-bromophenoxy)acetate CAS Name: 2-(4-bromophenoxy)acetic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 2-(4-bromophenoxy)acetate Traditional Name: 2-(4-bromophenoxy)acetic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C20H17BrO5 MolecularWeight: 417.24998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)COC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)COC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H17BrO5/c1-12-3-8-17-14(9-18(22)26-20(17)13(12)2)10-25-19(23)11-24-16-6-4-15(21)5-7-16/h3-9H,10-11H2,1-2H3