9-(5-bromanyl-2-ethoxy-phenyl)-2,6,7-tris(oxidanyl)xanthen-3-one

Systemtic Name: 9-(5-bromanyl-2-ethoxy-phenyl)-2,6,7-tris(oxidanyl)xanthen-3-one Openeye Name: 9-(5-bromo-2-ethoxy-phenyl)-2,6,7-trihydroxy-xanthen-3-one CAS Name: 9-(5-bromo-2-ethoxyphenyl)-2,6,7-trihydroxy-3-xanthenone IUPAC Name: 9-(5-bromo-2-ethoxyphenyl)-2,6,7-trihydroxyxanthen-3-one Traditional Name: 9-(5-bromo-2-ethoxy-phenyl)-2,6,7-trihydroxy-fluorone Formula: C21H15BrO6 MolecularWeight: 443.2442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O

InChI

InChI=1S/C21H15BrO6/c1-2-27-18-4-3-10(22)5-11(18)21-12-6-14(23)16(25)8-19(12)28-20-9-17(26)15(24)7-13(20)21/h3-9,23-25H,2H2,1H3