1-(2-bromanyl-5-oxidanyl-phenyl)-3-ethoxy-2-methyl-3-oxidanyl-prop-2-en-1-one

Systemtic Name: 1-(2-bromanyl-5-oxidanyl-phenyl)-3-ethoxy-2-methyl-3-oxidanyl-prop-2-en-1-one Openeye Name: 1-(2-bromo-5-hydroxy-phenyl)-3-ethoxy-3-hydroxy-2-methyl-prop-2-en-1-one CAS Name: 1-(2-bromo-5-hydroxyphenyl)-3-ethoxy-3-hydroxy-2-methyl-2-propen-1-one IUPAC Name: 1-(2-bromo-5-hydroxyphenyl)-3-ethoxy-3-hydroxy-2-methylprop-2-en-1-one Traditional Name: 1-(2-bromo-5-hydroxy-phenyl)-3-ethoxy-3-hydroxy-2-methyl-prop-2-en-1-one Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C)C(=O)C1=C(C=CC(=C1)O)Br)O

Isomeric SMILES

CCOC(=C(C)C(=O)C1=C(C=CC(=C1)O)Br)O

InChI

InChI=1S/C12H13BrO4/c1-3-17-12(16)7(2)11(15)9-6-8(14)4-5-10(9)13/h4-6,14,16H,3H2,1-2H3