methyl 2,2-bis(6-bromanyl-2-oxidanyl-4-oxidanylidene-chromen-3-yl)ethanoate

Systemtic Name: methyl 2,2-bis(6-bromanyl-2-oxidanyl-4-oxidanylidene-chromen-3-yl)ethanoate Openeye Name: methyl 2,2-bis(6-bromo-2-hydroxy-4-oxo-chromen-3-yl)acetate CAS Name: 2,2-bis(6-bromo-2-hydroxy-4-oxo-1-benzopyran-3-yl)acetic acid methyl ester IUPAC Name: methyl 2,2-bis(6-bromo-2-hydroxy-4-oxochromen-3-yl)acetate Traditional Name: 2,2-bis(6-bromo-2-hydroxy-4-keto-chromen-3-yl)acetic acid methyl ester Formula: C21H12Br2O8 MolecularWeight: 552.12318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=C(OC2=C(C1=O)C=C(C=C2)Br)O)C3=C(OC4=C(C3=O)C=C(C=C4)Br)O

Isomeric SMILES

COC(=O)C(C1=C(OC2=C(C1=O)C=C(C=C2)Br)O)C3=C(OC4=C(C3=O)C=C(C=C4)Br)O

InChI

InChI=1S/C21H12Br2O8/c1-29-19(26)14(15-17(24)10-6-8(22)2-4-12(10)30-20(15)27)16-18(25)11-7-9(23)3-5-13(11)31-21(16)28/h2-7,14,27-28H,1H3