3-bromanyl-4-ethoxy-1-methoxy-4-oxidanyl-but-3-en-2-one

Systemtic Name: 3-bromanyl-4-ethoxy-1-methoxy-4-oxidanyl-but-3-en-2-one Openeye Name: 3-bromo-4-ethoxy-4-hydroxy-1-methoxy-but-3-en-2-one CAS Name: 3-bromo-4-ethoxy-4-hydroxy-1-methoxy-3-buten-2-one IUPAC Name: 3-bromo-4-ethoxy-4-hydroxy-1-methoxybut-3-en-2-one Traditional Name: 3-bromo-4-ethoxy-4-hydroxy-1-methoxy-but-3-en-2-one Formula: C7H11BrO4 MolecularWeight: 239.06384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)COC)Br)O

Isomeric SMILES

CCOC(=C(C(=O)COC)Br)O

InChI

InChI=1S/C7H11BrO4/c1-3-12-7(10)6(8)5(9)4-11-2/h10H,3-4H2,1-2H3