(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(3-bromanylphenoxy)ethanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C20H17BrO5 MolecularWeight: 417.24998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)COC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)COC3=CC(=CC=C3)Br)C

InChI

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